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BBBP-V-SELFIE

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You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically penetration/non-penetration to the brain-blood barrier, based on the SELFIE string representation of each molecule. You will be provided with several example molecules, each accompanied by a binary label indicating whether it has penetrative property (Yes) or not (No). Please answer with only Yes or No. SELFIE: [C][=C][C][=Branch2][Ring1][Ring1][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][Ring2][C][O][C][O][C][Ring1][Branch2][=O][O][C][C][=C][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][C][#N] Penetration: Yes SELFIE: [C@H1][N][Branch2][Ring2][Ring2][C@H1][Branch2][Ring1][O][C][C][Branch1][Ring2][C][Ring1][=Branch1][N][C][Branch1][#C][C][=C][C][=C][C][=Branch1][=Branch1][=C][Ring1][=Branch1][O][C][O][C][=O][C][C][Ring2][Ring1][Branch1][C][C][=C][C][=C][C][=C][Ring1][=Branch1] Penetration: Yes SELFIE: [C][C][Branch1][C][C][Branch1][C][C][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][Branch1][Ring1][C][O][=N][Ring1][=Branch2] Penetration: No SELFIE: [C][C][Branch1][O][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][=Branch1][Ring2][=C][Ring1][#Branch1][C][Branch1][C][N][=O] Penetration: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C@H1][Branch2][Ring2][Branch1][C][N][Branch2][Ring1][Branch2][C][=C][C][=C][Branch1][=C][O][C][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][Cl][C][=C][Ring1][#C][C][Branch1][Branch1][O][Ring2][Ring1][Ring2][=O][C][N][C] Penetration: You have to predict whether it has Penetration with answer Yes or No.

Yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically penetration/non-penetration to the brain-blood barrier, based on the SELFIE string representation of each molecule. You will be provided with several example molecules, each accompanied by a binary label indicating whether it has penetrative property (Yes) or not (No). Please answer with only Yes or No. SELFIE: [C][=C][C][=Branch2][Ring1][Ring1][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][Ring2][C][O][C][O][C][Ring1][Branch2][=O][O][C][C][=C][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][C][#N] Penetration: Yes SELFIE: [C@H1][N][Branch2][Ring2][Ring2][C@H1][Branch2][Ring1][O][C][C][Branch1][Ring2][C][Ring1][=Branch1][N][C][Branch1][#C][C][=C][C][=C][C][=Branch1][=Branch1][=C][Ring1][=Branch1][O][C][O][C][=O][C][C][Ring2][Ring1][Branch1][C][C][=C][C][=C][C][=C][Ring1][=Branch1] Penetration: Yes SELFIE: [C][C][Branch1][C][C][Branch1][C][C][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][Branch1][Ring1][C][O][=N][Ring1][=Branch2] Penetration: No SELFIE: [C][C][Branch1][O][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][=Branch1][Ring2][=C][Ring1][#Branch1][C][Branch1][C][N][=O] Penetration: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C@@][Branch2][Ring1][Ring2][C@H1][Branch1][O][C][C][C][C][Ring1][=Branch1][C][C][Ring1][=Branch1][N][C][Branch1][C][C][C][Branch1][#C][C][=C][C][=Branch1][=Branch2][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][Cl][Cl][O] Penetration: You have to predict whether it has Penetration with answer Yes or No.

Yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically penetration/non-penetration to the brain-blood barrier, based on the SELFIE string representation of each molecule. You will be provided with several example molecules, each accompanied by a binary label indicating whether it has penetrative property (Yes) or not (No). Please answer with only Yes or No. SELFIE: [C][=C][C][=Branch2][Ring1][Ring1][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][Ring2][C][O][C][O][C][Ring1][Branch2][=O][O][C][C][=C][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][C][#N] Penetration: Yes SELFIE: [C@H1][N][Branch2][Ring2][Ring2][C@H1][Branch2][Ring1][O][C][C][Branch1][Ring2][C][Ring1][=Branch1][N][C][Branch1][#C][C][=C][C][=C][C][=Branch1][=Branch1][=C][Ring1][=Branch1][O][C][O][C][=O][C][C][Ring2][Ring1][Branch1][C][C][=C][C][=C][C][=C][Ring1][=Branch1] Penetration: Yes SELFIE: [C][C][Branch1][C][C][Branch1][C][C][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][Branch1][Ring1][C][O][=N][Ring1][=Branch2] Penetration: No SELFIE: [C][C][Branch1][O][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][=Branch1][Ring2][=C][Ring1][#Branch1][C][Branch1][C][N][=O] Penetration: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][Branch2][Ring1][C][C][Branch1][=C][O][C][Branch1][=Branch2][C][Branch1][C][Cl][Branch1][C][Cl][Cl][O][C][C][Branch1][C][C][Branch1][C][C][O] Penetration: You have to predict whether it has Penetration with answer Yes or No.

Yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically penetration/non-penetration to the brain-blood barrier, based on the SELFIE string representation of each molecule. You will be provided with several example molecules, each accompanied by a binary label indicating whether it has penetrative property (Yes) or not (No). Please answer with only Yes or No. SELFIE: [C][=C][C][=Branch2][Ring1][Ring1][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][Ring2][C][O][C][O][C][Ring1][Branch2][=O][O][C][C][=C][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][C][#N] Penetration: Yes SELFIE: [C@H1][N][Branch2][Ring2][Ring2][C@H1][Branch2][Ring1][O][C][C][Branch1][Ring2][C][Ring1][=Branch1][N][C][Branch1][#C][C][=C][C][=C][C][=Branch1][=Branch1][=C][Ring1][=Branch1][O][C][O][C][=O][C][C][Ring2][Ring1][Branch1][C][C][=C][C][=C][C][=C][Ring1][=Branch1] Penetration: Yes SELFIE: [C][C][Branch1][C][C][Branch1][C][C][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][Branch1][Ring1][C][O][=N][Ring1][=Branch2] Penetration: No SELFIE: [C][C][Branch1][O][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][=Branch1][Ring2][=C][Ring1][#Branch1][C][Branch1][C][N][=O] Penetration: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][=C][C][=C][C][=C][Ring1][=Branch1][N][Branch1][=C][C][=C][Branch1][#Branch1][C][=C][C][=C][Ring1][=Branch1][S][Ring1][#Branch2][C][C][Branch1][#Branch2][C][N][Branch1][C][C][C][C][Ring1][=Branch1][C] Penetration: You have to predict whether it has Penetration with answer Yes or No.

Yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically penetration/non-penetration to the brain-blood barrier, based on the SELFIE string representation of each molecule. You will be provided with several example molecules, each accompanied by a binary label indicating whether it has penetrative property (Yes) or not (No). Please answer with only Yes or No. SELFIE: [C][=C][C][=Branch2][Ring1][Ring1][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][Ring2][C][O][C][O][C][Ring1][Branch2][=O][O][C][C][=C][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][C][#N] Penetration: Yes SELFIE: [C@H1][N][Branch2][Ring2][Ring2][C@H1][Branch2][Ring1][O][C][C][Branch1][Ring2][C][Ring1][=Branch1][N][C][Branch1][#C][C][=C][C][=C][C][=Branch1][=Branch1][=C][Ring1][=Branch1][O][C][O][C][=O][C][C][Ring2][Ring1][Branch1][C][C][=C][C][=C][C][=C][Ring1][=Branch1] Penetration: Yes SELFIE: [C][C][Branch1][C][C][Branch1][C][C][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][Branch1][Ring1][C][O][=N][Ring1][=Branch2] Penetration: No SELFIE: [C][C][Branch1][O][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][=Branch1][Ring2][=C][Ring1][#Branch1][C][Branch1][C][N][=O] Penetration: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][Branch1][Ring2][NH1][Ring1][Branch1][C][N][C][C][N][Branch1][Branch2][C][C][Ring1][=Branch1][C][Ring1][O][C][C][C][C][Branch1][N][C][=C][C][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][F][=O] Penetration: You have to predict whether it has Penetration with answer Yes or No.

Yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically penetration/non-penetration to the brain-blood barrier, based on the SELFIE string representation of each molecule. You will be provided with several example molecules, each accompanied by a binary label indicating whether it has penetrative property (Yes) or not (No). Please answer with only Yes or No. SELFIE: [C][=C][C][=Branch2][Ring1][Ring1][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][Ring2][C][O][C][O][C][Ring1][Branch2][=O][O][C][C][=C][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][C][#N] Penetration: Yes SELFIE: [C@H1][N][Branch2][Ring2][Ring2][C@H1][Branch2][Ring1][O][C][C][Branch1][Ring2][C][Ring1][=Branch1][N][C][Branch1][#C][C][=C][C][=C][C][=Branch1][=Branch1][=C][Ring1][=Branch1][O][C][O][C][=O][C][C][Ring2][Ring1][Branch1][C][C][=C][C][=C][C][=C][Ring1][=Branch1] Penetration: Yes SELFIE: [C][C][Branch1][C][C][Branch1][C][C][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][Branch1][Ring1][C][O][=N][Ring1][=Branch2] Penetration: No SELFIE: [C][C][Branch1][O][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][=Branch1][Ring2][=C][Ring1][#Branch1][C][Branch1][C][N][=O] Penetration: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [H+1].[C][=C][Branch2][Ring1][=Branch2][C][Branch1][#C][C][Branch1][=Branch1][N][Branch1][C][C][C][C][=C][C][C][Ring1][=Branch2][C][Branch1][Ring2][O][C][C][=O][C][=C][C][=C][Ring2][Ring1][Ring2].[Cl-1] Penetration: You have to predict whether it has Penetration with answer Yes or No.

Yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically penetration/non-penetration to the brain-blood barrier, based on the SELFIE string representation of each molecule. You will be provided with several example molecules, each accompanied by a binary label indicating whether it has penetrative property (Yes) or not (No). Please answer with only Yes or No. SELFIE: [C][=C][C][=Branch2][Ring1][Ring1][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][Ring2][C][O][C][O][C][Ring1][Branch2][=O][O][C][C][=C][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][C][#N] Penetration: Yes SELFIE: [C@H1][N][Branch2][Ring2][Ring2][C@H1][Branch2][Ring1][O][C][C][Branch1][Ring2][C][Ring1][=Branch1][N][C][Branch1][#C][C][=C][C][=C][C][=Branch1][=Branch1][=C][Ring1][=Branch1][O][C][O][C][=O][C][C][Ring2][Ring1][Branch1][C][C][=C][C][=C][C][=C][Ring1][=Branch1] Penetration: Yes SELFIE: [C][C][Branch1][C][C][Branch1][C][C][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][Branch1][Ring1][C][O][=N][Ring1][=Branch2] Penetration: No SELFIE: [C][C][Branch1][O][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][=Branch1][Ring2][=C][Ring1][#Branch1][C][Branch1][C][N][=O] Penetration: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [F][C][=C][C][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][C][Branch2][Ring1][=C][C][C][C][N][C][C][C][Branch1][Branch1][C][C][Ring1][=Branch1][N][C][=Branch1][C][=O][N][C][=C][C][=C][C][=C][Ring1][#Branch2][Ring1][=Branch1][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1] Penetration: You have to predict whether it has Penetration with answer Yes or No.

Yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically penetration/non-penetration to the brain-blood barrier, based on the SELFIE string representation of each molecule. You will be provided with several example molecules, each accompanied by a binary label indicating whether it has penetrative property (Yes) or not (No). Please answer with only Yes or No. SELFIE: [C][=C][C][=Branch2][Ring1][Ring1][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][Ring2][C][O][C][O][C][Ring1][Branch2][=O][O][C][C][=C][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][C][#N] Penetration: Yes SELFIE: [C@H1][N][Branch2][Ring2][Ring2][C@H1][Branch2][Ring1][O][C][C][Branch1][Ring2][C][Ring1][=Branch1][N][C][Branch1][#C][C][=C][C][=C][C][=Branch1][=Branch1][=C][Ring1][=Branch1][O][C][O][C][=O][C][C][Ring2][Ring1][Branch1][C][C][=C][C][=C][C][=C][Ring1][=Branch1] Penetration: Yes SELFIE: [C][C][Branch1][C][C][Branch1][C][C][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][Branch1][Ring1][C][O][=N][Ring1][=Branch2] Penetration: No SELFIE: [C][C][Branch1][O][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][=Branch1][Ring2][=C][Ring1][#Branch1][C][Branch1][C][N][=O] Penetration: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][Branch1][=Branch2][N][C][C][O][C][C][Ring1][=Branch1][C][N][C][=N][N][C][Branch1][=Branch1][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=Branch1][C][=O][C][=C][Ring1][#Branch1] Penetration: You have to predict whether it has Penetration with answer Yes or No.

Yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically penetration/non-penetration to the brain-blood barrier, based on the SELFIE string representation of each molecule. You will be provided with several example molecules, each accompanied by a binary label indicating whether it has penetrative property (Yes) or not (No). Please answer with only Yes or No. SELFIE: [C][=C][C][=Branch2][Ring1][Ring1][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][Ring2][C][O][C][O][C][Ring1][Branch2][=O][O][C][C][=C][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][C][#N] Penetration: Yes SELFIE: [C@H1][N][Branch2][Ring2][Ring2][C@H1][Branch2][Ring1][O][C][C][Branch1][Ring2][C][Ring1][=Branch1][N][C][Branch1][#C][C][=C][C][=C][C][=Branch1][=Branch1][=C][Ring1][=Branch1][O][C][O][C][=O][C][C][Ring2][Ring1][Branch1][C][C][=C][C][=C][C][=C][Ring1][=Branch1] Penetration: Yes SELFIE: [C][C][Branch1][C][C][Branch1][C][C][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][Branch1][Ring1][C][O][=N][Ring1][=Branch2] Penetration: No SELFIE: [C][C][Branch1][O][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][=Branch1][Ring2][=C][Ring1][#Branch1][C][Branch1][C][N][=O] Penetration: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][C][C@][Branch1][C][O][C][C@H1][C][N][Branch2][#Branch1][=C][C][C][C][=C][Branch1][N][NH1][C][=C][C][=C][C][=C][Ring1][=Branch2][Ring1][=Branch1][C@@][Branch1][Ring2][C][Ring1][S][Branch1][#Branch1][C][=Branch1][C][=O][O][C][C][=C][C][=C][Branch1][#Branch1][C][=C][Ring1][=Branch1][O][C][N][Branch1][C][C][C@H1][C@][Branch1][C][O][Branch2][Ring1][P][C@H1][Branch1][#Branch1][O][C][Branch1][C][C][=O][C@][Branch1][Ring1][C][C][C][=C][C][N][C][C][C@][Ring2][Ring1][#Branch2][Ring2][Ring1][C][C@H1][Ring1][O][Ring1][Branch1][C][=Branch1][C][=O][O][C][C][Ring2][Branch1][=Branch2] Penetration: You have to predict whether it has Penetration with answer Yes or No.

Yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically penetration/non-penetration to the brain-blood barrier, based on the SELFIE string representation of each molecule. You will be provided with several example molecules, each accompanied by a binary label indicating whether it has penetrative property (Yes) or not (No). Please answer with only Yes or No. SELFIE: [C][=C][C][=Branch2][Ring1][Ring1][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][Ring2][C][O][C][O][C][Ring1][Branch2][=O][O][C][C][=C][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][C][#N] Penetration: Yes SELFIE: [C@H1][N][Branch2][Ring2][Ring2][C@H1][Branch2][Ring1][O][C][C][Branch1][Ring2][C][Ring1][=Branch1][N][C][Branch1][#C][C][=C][C][=C][C][=Branch1][=Branch1][=C][Ring1][=Branch1][O][C][O][C][=O][C][C][Ring2][Ring1][Branch1][C][C][=C][C][=C][C][=C][Ring1][=Branch1] Penetration: Yes SELFIE: [C][C][Branch1][C][C][Branch1][C][C][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][Branch1][Ring1][C][O][=N][Ring1][=Branch2] Penetration: No SELFIE: [C][C][Branch1][O][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][=Branch1][Ring2][=C][Ring1][#Branch1][C][Branch1][C][N][=O] Penetration: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][=C][N][=C][C][=C][Ring1][=Branch1][C][Branch1][Branch2][N][N][C][Branch1][C][C][C][=O] Penetration: You have to predict whether it has Penetration with answer Yes or No.

Yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically penetration/non-penetration to the brain-blood barrier, based on the SELFIE string representation of each molecule. You will be provided with several example molecules, each accompanied by a binary label indicating whether it has penetrative property (Yes) or not (No). Please answer with only Yes or No. SELFIE: [C][=C][C][=Branch2][Ring1][Ring1][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][Ring2][C][O][C][O][C][Ring1][Branch2][=O][O][C][C][=C][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][C][#N] Penetration: Yes SELFIE: [C@H1][N][Branch2][Ring2][Ring2][C@H1][Branch2][Ring1][O][C][C][Branch1][Ring2][C][Ring1][=Branch1][N][C][Branch1][#C][C][=C][C][=C][C][=Branch1][=Branch1][=C][Ring1][=Branch1][O][C][O][C][=O][C][C][Ring2][Ring1][Branch1][C][C][=C][C][=C][C][=C][Ring1][=Branch1] Penetration: Yes SELFIE: [C][C][Branch1][C][C][Branch1][C][C][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][Branch1][Ring1][C][O][=N][Ring1][=Branch2] Penetration: No SELFIE: [C][C][Branch1][O][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][=Branch1][Ring2][=C][Ring1][#Branch1][C][Branch1][C][N][=O] Penetration: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][=Branch1][=C][=C][C][=C][Branch1][Branch2][C][=Branch1][Ring2][=C][Ring1][=Branch1][Cl][Cl][C][C][Branch2][Ring1][=N][N][C@H1][Branch1][N][C][N@@][C][C@@H1][Branch1][Branch1][C][C][Ring1][Branch1][O][C][N][Branch1][Branch1][C][C][Ring1][=N][C][=C][N][=Ring1][#Branch1][=O] Penetration: You have to predict whether it has Penetration with answer Yes or No.

No

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically penetration/non-penetration to the brain-blood barrier, based on the SELFIE string representation of each molecule. You will be provided with several example molecules, each accompanied by a binary label indicating whether it has penetrative property (Yes) or not (No). Please answer with only Yes or No. SELFIE: [C][=C][C][=Branch2][Ring1][Ring1][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][Ring2][C][O][C][O][C][Ring1][Branch2][=O][O][C][C][=C][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][C][#N] Penetration: Yes SELFIE: [C@H1][N][Branch2][Ring2][Ring2][C@H1][Branch2][Ring1][O][C][C][Branch1][Ring2][C][Ring1][=Branch1][N][C][Branch1][#C][C][=C][C][=C][C][=Branch1][=Branch1][=C][Ring1][=Branch1][O][C][O][C][=O][C][C][Ring2][Ring1][Branch1][C][C][=C][C][=C][C][=C][Ring1][=Branch1] Penetration: Yes SELFIE: [C][C][Branch1][C][C][Branch1][C][C][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][Branch1][Ring1][C][O][=N][Ring1][=Branch2] Penetration: No SELFIE: [C][C][Branch1][O][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][=Branch1][Ring2][=C][Ring1][#Branch1][C][Branch1][C][N][=O] Penetration: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][N][Branch1][C][C][C][C][O][C][=Branch1][C][=O][C][O][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1] Penetration: You have to predict whether it has Penetration with answer Yes or No.

Yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically penetration/non-penetration to the brain-blood barrier, based on the SELFIE string representation of each molecule. You will be provided with several example molecules, each accompanied by a binary label indicating whether it has penetrative property (Yes) or not (No). Please answer with only Yes or No. SELFIE: [C][=C][C][=Branch2][Ring1][Ring1][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][Ring2][C][O][C][O][C][Ring1][Branch2][=O][O][C][C][=C][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][C][#N] Penetration: Yes SELFIE: [C@H1][N][Branch2][Ring2][Ring2][C@H1][Branch2][Ring1][O][C][C][Branch1][Ring2][C][Ring1][=Branch1][N][C][Branch1][#C][C][=C][C][=C][C][=Branch1][=Branch1][=C][Ring1][=Branch1][O][C][O][C][=O][C][C][Ring2][Ring1][Branch1][C][C][=C][C][=C][C][=C][Ring1][=Branch1] Penetration: Yes SELFIE: [C][C][Branch1][C][C][Branch1][C][C][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][Branch1][Ring1][C][O][=N][Ring1][=Branch2] Penetration: No SELFIE: [C][C][Branch1][O][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][=Branch1][Ring2][=C][Ring1][#Branch1][C][Branch1][C][N][=O] Penetration: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C@][Branch2][Branch1][#Branch2][C@H1][Branch2][Ring2][C][C@H1][C@][Branch2][Ring1][Branch1][C@@][Branch1][#Branch1][O][C][Branch1][C][C][=O][Branch1][=Branch1][C][Branch1][C][C][=O][C][C][Ring1][N][Branch1][C][C][C][C@@H1][Ring1][P][O][C][C@H1][Branch1][C][C][C][=C][C][=Branch1][C][=O][C][=C][C@][Ring2][Ring1][N][Ring1][#Branch1][C][F] Penetration: You have to predict whether it has Penetration with answer Yes or No.

Yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically penetration/non-penetration to the brain-blood barrier, based on the SELFIE string representation of each molecule. You will be provided with several example molecules, each accompanied by a binary label indicating whether it has penetrative property (Yes) or not (No). Please answer with only Yes or No. SELFIE: [C][=C][C][=Branch2][Ring1][Ring1][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][Ring2][C][O][C][O][C][Ring1][Branch2][=O][O][C][C][=C][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][C][#N] Penetration: Yes SELFIE: [C@H1][N][Branch2][Ring2][Ring2][C@H1][Branch2][Ring1][O][C][C][Branch1][Ring2][C][Ring1][=Branch1][N][C][Branch1][#C][C][=C][C][=C][C][=Branch1][=Branch1][=C][Ring1][=Branch1][O][C][O][C][=O][C][C][Ring2][Ring1][Branch1][C][C][=C][C][=C][C][=C][Ring1][=Branch1] Penetration: Yes SELFIE: [C][C][Branch1][C][C][Branch1][C][C][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][Branch1][Ring1][C][O][=N][Ring1][=Branch2] Penetration: No SELFIE: [C][C][Branch1][O][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][=Branch1][Ring2][=C][Ring1][#Branch1][C][Branch1][C][N][=O] Penetration: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][N][C][C][C][C][C][C][C][Branch1][O][C][=C][C][=C][C][=C][Ring1][#Branch2][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][S][Ring1][=Branch1] Penetration: You have to predict whether it has Penetration with answer Yes or No.

Yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically penetration/non-penetration to the brain-blood barrier, based on the SELFIE string representation of each molecule. You will be provided with several example molecules, each accompanied by a binary label indicating whether it has penetrative property (Yes) or not (No). Please answer with only Yes or No. SELFIE: [C][=C][C][=Branch2][Ring1][Ring1][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][Ring2][C][O][C][O][C][Ring1][Branch2][=O][O][C][C][=C][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][C][#N] Penetration: Yes SELFIE: [C@H1][N][Branch2][Ring2][Ring2][C@H1][Branch2][Ring1][O][C][C][Branch1][Ring2][C][Ring1][=Branch1][N][C][Branch1][#C][C][=C][C][=C][C][=Branch1][=Branch1][=C][Ring1][=Branch1][O][C][O][C][=O][C][C][Ring2][Ring1][Branch1][C][C][=C][C][=C][C][=C][Ring1][=Branch1] Penetration: Yes SELFIE: [C][C][Branch1][C][C][Branch1][C][C][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][Branch1][Ring1][C][O][=N][Ring1][=Branch2] Penetration: No SELFIE: [C][C][Branch1][O][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][=Branch1][Ring2][=C][Ring1][#Branch1][C][Branch1][C][N][=O] Penetration: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][C][Branch1][=Branch1][C][Branch1][C][O][=O][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1] Penetration: You have to predict whether it has Penetration with answer Yes or No.

Yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically penetration/non-penetration to the brain-blood barrier, based on the SELFIE string representation of each molecule. You will be provided with several example molecules, each accompanied by a binary label indicating whether it has penetrative property (Yes) or not (No). Please answer with only Yes or No. SELFIE: [C][=C][C][=Branch2][Ring1][Ring1][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][Ring2][C][O][C][O][C][Ring1][Branch2][=O][O][C][C][=C][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][C][#N] Penetration: Yes SELFIE: [C@H1][N][Branch2][Ring2][Ring2][C@H1][Branch2][Ring1][O][C][C][Branch1][Ring2][C][Ring1][=Branch1][N][C][Branch1][#C][C][=C][C][=C][C][=Branch1][=Branch1][=C][Ring1][=Branch1][O][C][O][C][=O][C][C][Ring2][Ring1][Branch1][C][C][=C][C][=C][C][=C][Ring1][=Branch1] Penetration: Yes SELFIE: [C][C][Branch1][C][C][Branch1][C][C][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][Branch1][Ring1][C][O][=N][Ring1][=Branch2] Penetration: No SELFIE: [C][C][Branch1][O][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][=Branch1][Ring2][=C][Ring1][#Branch1][C][Branch1][C][N][=O] Penetration: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][=C][Branch1][Ring1][O][C][C][=C][C][=C][Ring1][Branch2][C][Branch1][=C][C][=C][Branch1][#Branch1][C][=C][C][=C][Ring1][=Branch1][S][Ring1][#Branch2][Branch1][=Branch2][C][C][C][N][Branch1][C][C][C][O] Penetration: You have to predict whether it has Penetration with answer Yes or No.

Yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically penetration/non-penetration to the brain-blood barrier, based on the SELFIE string representation of each molecule. You will be provided with several example molecules, each accompanied by a binary label indicating whether it has penetrative property (Yes) or not (No). Please answer with only Yes or No. SELFIE: [C][=C][C][=Branch2][Ring1][Ring1][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][Ring2][C][O][C][O][C][Ring1][Branch2][=O][O][C][C][=C][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][C][#N] Penetration: Yes SELFIE: [C@H1][N][Branch2][Ring2][Ring2][C@H1][Branch2][Ring1][O][C][C][Branch1][Ring2][C][Ring1][=Branch1][N][C][Branch1][#C][C][=C][C][=C][C][=Branch1][=Branch1][=C][Ring1][=Branch1][O][C][O][C][=O][C][C][Ring2][Ring1][Branch1][C][C][=C][C][=C][C][=C][Ring1][=Branch1] Penetration: Yes SELFIE: [C][C][Branch1][C][C][Branch1][C][C][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][Branch1][Ring1][C][O][=N][Ring1][=Branch2] Penetration: No SELFIE: [C][C][Branch1][O][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][=Branch1][Ring2][=C][Ring1][#Branch1][C][Branch1][C][N][=O] Penetration: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][=C][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][C][C][C][=Branch1][Ring2][=C][Ring1][=Branch2][C][C][=N][C][N][C][Ring1][Branch1] Penetration: You have to predict whether it has Penetration with answer Yes or No.

Yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically penetration/non-penetration to the brain-blood barrier, based on the SELFIE string representation of each molecule. You will be provided with several example molecules, each accompanied by a binary label indicating whether it has penetrative property (Yes) or not (No). Please answer with only Yes or No. SELFIE: [C][=C][C][=Branch2][Ring1][Ring1][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][Ring2][C][O][C][O][C][Ring1][Branch2][=O][O][C][C][=C][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][C][#N] Penetration: Yes SELFIE: [C@H1][N][Branch2][Ring2][Ring2][C@H1][Branch2][Ring1][O][C][C][Branch1][Ring2][C][Ring1][=Branch1][N][C][Branch1][#C][C][=C][C][=C][C][=Branch1][=Branch1][=C][Ring1][=Branch1][O][C][O][C][=O][C][C][Ring2][Ring1][Branch1][C][C][=C][C][=C][C][=C][Ring1][=Branch1] Penetration: Yes SELFIE: [C][C][Branch1][C][C][Branch1][C][C][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][Branch1][Ring1][C][O][=N][Ring1][=Branch2] Penetration: No SELFIE: [C][C][Branch1][O][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][=Branch1][Ring2][=C][Ring1][#Branch1][C][Branch1][C][N][=O] Penetration: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][C][Branch1][C][C][S][C@@H1][C@H1][Branch1][P][N][C][=Branch1][C][=O][C][Branch1][C][N][C][C][C][C][C][Ring1][#Branch1][C][=Branch1][C][=O][N][Ring1][#C][C@H1][Ring2][Ring1][Ring1][C][Branch1][C][O][=O] Penetration: You have to predict whether it has Penetration with answer Yes or No.

No

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically penetration/non-penetration to the brain-blood barrier, based on the SELFIE string representation of each molecule. You will be provided with several example molecules, each accompanied by a binary label indicating whether it has penetrative property (Yes) or not (No). Please answer with only Yes or No. SELFIE: [C][=C][C][=Branch2][Ring1][Ring1][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][Ring2][C][O][C][O][C][Ring1][Branch2][=O][O][C][C][=C][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][C][#N] Penetration: Yes SELFIE: [C@H1][N][Branch2][Ring2][Ring2][C@H1][Branch2][Ring1][O][C][C][Branch1][Ring2][C][Ring1][=Branch1][N][C][Branch1][#C][C][=C][C][=C][C][=Branch1][=Branch1][=C][Ring1][=Branch1][O][C][O][C][=O][C][C][Ring2][Ring1][Branch1][C][C][=C][C][=C][C][=C][Ring1][=Branch1] Penetration: Yes SELFIE: [C][C][Branch1][C][C][Branch1][C][C][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][Branch1][Ring1][C][O][=N][Ring1][=Branch2] Penetration: No SELFIE: [C][C][Branch1][O][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][=Branch1][Ring2][=C][Ring1][#Branch1][C][Branch1][C][N][=O] Penetration: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][C][=C][Branch2][Ring2][=C][N][C@H1][Branch1][Branch1][S][C][Ring1][=Branch1][C@H1][Branch2][Ring1][=N][N][C][=Branch1][C][=O][C@H1][Branch1][C][N][C][=C][C][=C][C][Branch1][#Branch2][N][SH0][Branch1][C][C][=Branch1][C][=O][=O][=C][Ring1][O][C][Ring2][Ring1][=Branch1][=O][C][Branch1][C][O][=O] Penetration: You have to predict whether it has Penetration with answer Yes or No.

No

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically penetration/non-penetration to the brain-blood barrier, based on the SELFIE string representation of each molecule. You will be provided with several example molecules, each accompanied by a binary label indicating whether it has penetrative property (Yes) or not (No). Please answer with only Yes or No. SELFIE: [C][=C][C][=Branch2][Ring1][Ring1][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][Ring2][C][O][C][O][C][Ring1][Branch2][=O][O][C][C][=C][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][C][#N] Penetration: Yes SELFIE: [C@H1][N][Branch2][Ring2][Ring2][C@H1][Branch2][Ring1][O][C][C][Branch1][Ring2][C][Ring1][=Branch1][N][C][Branch1][#C][C][=C][C][=C][C][=Branch1][=Branch1][=C][Ring1][=Branch1][O][C][O][C][=O][C][C][Ring2][Ring1][Branch1][C][C][=C][C][=C][C][=C][Ring1][=Branch1] Penetration: Yes SELFIE: [C][C][Branch1][C][C][Branch1][C][C][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][Branch1][Ring1][C][O][=N][Ring1][=Branch2] Penetration: No SELFIE: [C][C][Branch1][O][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][=Branch1][Ring2][=C][Ring1][#Branch1][C][Branch1][C][N][=O] Penetration: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][C][Branch1][C][C][Branch1][C][C][C][=Branch1][C][=O][O][C][O][C][=Branch1][C][=O][C@@H1][N][C@H1][Branch1][=Branch2][S][C][Ring1][Branch1][Branch1][C][C][C][C@H1][Branch2][Ring1][C][N][C][=Branch1][C][=O][C@H1][Branch1][C][N][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring2][Ring1][Ring1][=O] Penetration: You have to predict whether it has Penetration with answer Yes or No.

No

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically penetration/non-penetration to the brain-blood barrier, based on the SELFIE string representation of each molecule. You will be provided with several example molecules, each accompanied by a binary label indicating whether it has penetrative property (Yes) or not (No). Please answer with only Yes or No. SELFIE: [C][=C][C][=Branch2][Ring1][Ring1][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][Ring2][C][O][C][O][C][Ring1][Branch2][=O][O][C][C][=C][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][C][#N] Penetration: Yes SELFIE: [C@H1][N][Branch2][Ring2][Ring2][C@H1][Branch2][Ring1][O][C][C][Branch1][Ring2][C][Ring1][=Branch1][N][C][Branch1][#C][C][=C][C][=C][C][=Branch1][=Branch1][=C][Ring1][=Branch1][O][C][O][C][=O][C][C][Ring2][Ring1][Branch1][C][C][=C][C][=C][C][=C][Ring1][=Branch1] Penetration: Yes SELFIE: [C][C][Branch1][C][C][Branch1][C][C][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][Branch1][Ring1][C][O][=N][Ring1][=Branch2] Penetration: No SELFIE: [C][C][Branch1][O][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][=Branch1][Ring2][=C][Ring1][#Branch1][C][Branch1][C][N][=O] Penetration: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][C][N][C][=C][Branch1][=Branch1][C][Branch1][C][O][=O][C][=Branch1][C][=O][C][=C][C][Branch1][C][F][=C][Branch1][N][N][C][C][N][C][Branch1][C][C][C][Ring1][#Branch1][C][Branch1][C][F][=C][Ring2][Ring1][#Branch1][Ring1][#C] Penetration: You have to predict whether it has Penetration with answer Yes or No.

No

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically penetration/non-penetration to the brain-blood barrier, based on the SELFIE string representation of each molecule. You will be provided with several example molecules, each accompanied by a binary label indicating whether it has penetrative property (Yes) or not (No). Please answer with only Yes or No. SELFIE: [C][=C][C][=Branch2][Ring1][Ring1][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][Ring2][C][O][C][O][C][Ring1][Branch2][=O][O][C][C][=C][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][C][#N] Penetration: Yes SELFIE: [C@H1][N][Branch2][Ring2][Ring2][C@H1][Branch2][Ring1][O][C][C][Branch1][Ring2][C][Ring1][=Branch1][N][C][Branch1][#C][C][=C][C][=C][C][=Branch1][=Branch1][=C][Ring1][=Branch1][O][C][O][C][=O][C][C][Ring2][Ring1][Branch1][C][C][=C][C][=C][C][=C][Ring1][=Branch1] Penetration: Yes SELFIE: [C][C][Branch1][C][C][Branch1][C][C][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][Branch1][Ring1][C][O][=N][Ring1][=Branch2] Penetration: No SELFIE: [C][C][Branch1][O][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][=Branch1][Ring2][=C][Ring1][#Branch1][C][Branch1][C][N][=O] Penetration: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][=C][Branch2][Ring1][Ring2][O][C][Branch1][#Branch2][O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][N][Branch1][C][C][C][C][=C][C][=C][Ring2][Ring1][Ring1] Penetration: You have to predict whether it has Penetration with answer Yes or No.

Yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically penetration/non-penetration to the brain-blood barrier, based on the SELFIE string representation of each molecule. You will be provided with several example molecules, each accompanied by a binary label indicating whether it has penetrative property (Yes) or not (No). Please answer with only Yes or No. SELFIE: [C][=C][C][=Branch2][Ring1][Ring1][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][Ring2][C][O][C][O][C][Ring1][Branch2][=O][O][C][C][=C][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][C][#N] Penetration: Yes SELFIE: [C@H1][N][Branch2][Ring2][Ring2][C@H1][Branch2][Ring1][O][C][C][Branch1][Ring2][C][Ring1][=Branch1][N][C][Branch1][#C][C][=C][C][=C][C][=Branch1][=Branch1][=C][Ring1][=Branch1][O][C][O][C][=O][C][C][Ring2][Ring1][Branch1][C][C][=C][C][=C][C][=C][Ring1][=Branch1] Penetration: Yes SELFIE: [C][C][Branch1][C][C][Branch1][C][C][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][Branch1][Ring1][C][O][=N][Ring1][=Branch2] Penetration: No SELFIE: [C][C][Branch1][O][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][=Branch1][Ring2][=C][Ring1][#Branch1][C][Branch1][C][N][=O] Penetration: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][C][C][C][C][C][Ring1][=Branch1] Penetration: You have to predict whether it has Penetration with answer Yes or No.

Yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically penetration/non-penetration to the brain-blood barrier, based on the SELFIE string representation of each molecule. You will be provided with several example molecules, each accompanied by a binary label indicating whether it has penetrative property (Yes) or not (No). Please answer with only Yes or No. SELFIE: [C][=C][C][=Branch2][Ring1][Ring1][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][Ring2][C][O][C][O][C][Ring1][Branch2][=O][O][C][C][=C][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][C][#N] Penetration: Yes SELFIE: [C@H1][N][Branch2][Ring2][Ring2][C@H1][Branch2][Ring1][O][C][C][Branch1][Ring2][C][Ring1][=Branch1][N][C][Branch1][#C][C][=C][C][=C][C][=Branch1][=Branch1][=C][Ring1][=Branch1][O][C][O][C][=O][C][C][Ring2][Ring1][Branch1][C][C][=C][C][=C][C][=C][Ring1][=Branch1] Penetration: Yes SELFIE: [C][C][Branch1][C][C][Branch1][C][C][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][Branch1][Ring1][C][O][=N][Ring1][=Branch2] Penetration: No SELFIE: [C][C][Branch1][O][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][=Branch1][Ring2][=C][Ring1][#Branch1][C][Branch1][C][N][=O] Penetration: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][Branch1][Ring2][NH1][Ring1][Branch1][C][C][C][Branch1][Ring2][C][Ring1][#Branch1][N][Branch1][C][C][C] Penetration: You have to predict whether it has Penetration with answer Yes or No.

Yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically penetration/non-penetration to the brain-blood barrier, based on the SELFIE string representation of each molecule. You will be provided with several example molecules, each accompanied by a binary label indicating whether it has penetrative property (Yes) or not (No). Please answer with only Yes or No. SELFIE: [C][=C][C][=Branch2][Ring1][Ring1][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][Ring2][C][O][C][O][C][Ring1][Branch2][=O][O][C][C][=C][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][C][#N] Penetration: Yes SELFIE: [C@H1][N][Branch2][Ring2][Ring2][C@H1][Branch2][Ring1][O][C][C][Branch1][Ring2][C][Ring1][=Branch1][N][C][Branch1][#C][C][=C][C][=C][C][=Branch1][=Branch1][=C][Ring1][=Branch1][O][C][O][C][=O][C][C][Ring2][Ring1][Branch1][C][C][=C][C][=C][C][=C][Ring1][=Branch1] Penetration: Yes SELFIE: [C][C][Branch1][C][C][Branch1][C][C][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][Branch1][Ring1][C][O][=N][Ring1][=Branch2] Penetration: No SELFIE: [C][C][Branch1][O][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][=Branch1][Ring2][=C][Ring1][#Branch1][C][Branch1][C][N][=O] Penetration: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][=C][Branch1][C][O][C][=C][C][=C][Ring1][#Branch1][C][=Branch2][Ring1][Branch1][=C][Branch1][C][C][NH0][Ring1][=Branch1][C][C][=C][C][=C][Branch1][Ring1][O][C][C][=C][Ring1][Branch2][C][C][N] Penetration: You have to predict whether it has Penetration with answer Yes or No.

Yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically penetration/non-penetration to the brain-blood barrier, based on the SELFIE string representation of each molecule. You will be provided with several example molecules, each accompanied by a binary label indicating whether it has penetrative property (Yes) or not (No). Please answer with only Yes or No. SELFIE: [C][=C][C][=Branch2][Ring1][Ring1][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][Ring2][C][O][C][O][C][Ring1][Branch2][=O][O][C][C][=C][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][C][#N] Penetration: Yes SELFIE: [C@H1][N][Branch2][Ring2][Ring2][C@H1][Branch2][Ring1][O][C][C][Branch1][Ring2][C][Ring1][=Branch1][N][C][Branch1][#C][C][=C][C][=C][C][=Branch1][=Branch1][=C][Ring1][=Branch1][O][C][O][C][=O][C][C][Ring2][Ring1][Branch1][C][C][=C][C][=C][C][=C][Ring1][=Branch1] Penetration: Yes SELFIE: [C][C][Branch1][C][C][Branch1][C][C][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][Branch1][Ring1][C][O][=N][Ring1][=Branch2] Penetration: No SELFIE: [C][C][Branch1][O][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][=Branch1][Ring2][=C][Ring1][#Branch1][C][Branch1][C][N][=O] Penetration: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][C][Branch1][C][C][C][=C][C][=C][C][Branch1][=Branch1][C][Branch1][C][C][C][=C][Ring1][=Branch2][O] Penetration: You have to predict whether it has Penetration with answer Yes or No.

Yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically penetration/non-penetration to the brain-blood barrier, based on the SELFIE string representation of each molecule. You will be provided with several example molecules, each accompanied by a binary label indicating whether it has penetrative property (Yes) or not (No). Please answer with only Yes or No. SELFIE: [C][=C][C][=Branch2][Ring1][Ring1][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][Ring2][C][O][C][O][C][Ring1][Branch2][=O][O][C][C][=C][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][C][#N] Penetration: Yes SELFIE: [C@H1][N][Branch2][Ring2][Ring2][C@H1][Branch2][Ring1][O][C][C][Branch1][Ring2][C][Ring1][=Branch1][N][C][Branch1][#C][C][=C][C][=C][C][=Branch1][=Branch1][=C][Ring1][=Branch1][O][C][O][C][=O][C][C][Ring2][Ring1][Branch1][C][C][=C][C][=C][C][=C][Ring1][=Branch1] Penetration: Yes SELFIE: [C][C][Branch1][C][C][Branch1][C][C][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][Branch1][Ring1][C][O][=N][Ring1][=Branch2] Penetration: No SELFIE: [C][C][Branch1][O][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][=Branch1][Ring2][=C][Ring1][#Branch1][C][Branch1][C][N][=O] Penetration: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][=C][C][=Branch2][Branch1][=N][=C][C][=C][Ring1][=Branch1][C][C][C][C][Ring1][=Branch1][Branch2][Ring2][Ring1][C][Branch2][Ring1][O][C][Branch1][Ring1][O][C][Branch1][S][C][Branch1][Ring2][C][Ring1][Branch2][C][Branch1][Ring1][C][C][Branch1][C][C][O][C][=C][Ring1][#C][O][Ring2][Ring1][Branch1][C][C][N][Ring2][Ring1][Ring2][C][C][C][C][Ring1][Ring1][O][C] Penetration: You have to predict whether it has Penetration with answer Yes or No.

Yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically penetration/non-penetration to the brain-blood barrier, based on the SELFIE string representation of each molecule. You will be provided with several example molecules, each accompanied by a binary label indicating whether it has penetrative property (Yes) or not (No). Please answer with only Yes or No. SELFIE: [C][=C][C][=Branch2][Ring1][Ring1][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][Ring2][C][O][C][O][C][Ring1][Branch2][=O][O][C][C][=C][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][C][#N] Penetration: Yes SELFIE: [C@H1][N][Branch2][Ring2][Ring2][C@H1][Branch2][Ring1][O][C][C][Branch1][Ring2][C][Ring1][=Branch1][N][C][Branch1][#C][C][=C][C][=C][C][=Branch1][=Branch1][=C][Ring1][=Branch1][O][C][O][C][=O][C][C][Ring2][Ring1][Branch1][C][C][=C][C][=C][C][=C][Ring1][=Branch1] Penetration: Yes SELFIE: [C][C][Branch1][C][C][Branch1][C][C][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][Branch1][Ring1][C][O][=N][Ring1][=Branch2] Penetration: No SELFIE: [C][C][Branch1][O][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][=Branch1][Ring2][=C][Ring1][#Branch1][C][Branch1][C][N][=O] Penetration: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][=C][Branch1][Ring1][O][C][C][=C][C][=N][C][=C][C][=Branch1][=Branch1][=C][Ring1][N][Ring1][=Branch1][C][C][C][C][C][Branch1][#Branch1][C][N][C][C][Ring1][=Branch1][C][=C] Penetration: You have to predict whether it has Penetration with answer Yes or No.

Yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically penetration/non-penetration to the brain-blood barrier, based on the SELFIE string representation of each molecule. You will be provided with several example molecules, each accompanied by a binary label indicating whether it has penetrative property (Yes) or not (No). Please answer with only Yes or No. SELFIE: [C][=C][C][=Branch2][Ring1][Ring1][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][Ring2][C][O][C][O][C][Ring1][Branch2][=O][O][C][C][=C][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][C][#N] Penetration: Yes SELFIE: [C@H1][N][Branch2][Ring2][Ring2][C@H1][Branch2][Ring1][O][C][C][Branch1][Ring2][C][Ring1][=Branch1][N][C][Branch1][#C][C][=C][C][=C][C][=Branch1][=Branch1][=C][Ring1][=Branch1][O][C][O][C][=O][C][C][Ring2][Ring1][Branch1][C][C][=C][C][=C][C][=C][Ring1][=Branch1] Penetration: Yes SELFIE: [C][C][Branch1][C][C][Branch1][C][C][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][Branch1][Ring1][C][O][=N][Ring1][=Branch2] Penetration: No SELFIE: [C][C][Branch1][O][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][=Branch1][Ring2][=C][Ring1][#Branch1][C][Branch1][C][N][=O] Penetration: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][C@][Branch1][C][O][C][C][C@H1][C@@H1][C][C][C@H1][C][C][NH1][N][=C][C][=Ring1][Branch1][C][C@][Ring1][=Branch2][Branch1][C][C][C@H1][Ring1][=C][C][C][C@][Ring2][Ring1][=Branch1][Ring2][Ring1][C][C] Penetration: You have to predict whether it has Penetration with answer Yes or No.

No

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically penetration/non-penetration to the brain-blood barrier, based on the SELFIE string representation of each molecule. You will be provided with several example molecules, each accompanied by a binary label indicating whether it has penetrative property (Yes) or not (No). Please answer with only Yes or No. SELFIE: [C][=C][C][=Branch2][Ring1][Ring1][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][Ring2][C][O][C][O][C][Ring1][Branch2][=O][O][C][C][=C][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][C][#N] Penetration: Yes SELFIE: [C@H1][N][Branch2][Ring2][Ring2][C@H1][Branch2][Ring1][O][C][C][Branch1][Ring2][C][Ring1][=Branch1][N][C][Branch1][#C][C][=C][C][=C][C][=Branch1][=Branch1][=C][Ring1][=Branch1][O][C][O][C][=O][C][C][Ring2][Ring1][Branch1][C][C][=C][C][=C][C][=C][Ring1][=Branch1] Penetration: Yes SELFIE: [C][C][Branch1][C][C][Branch1][C][C][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][Branch1][Ring1][C][O][=N][Ring1][=Branch2] Penetration: No SELFIE: [C][C][Branch1][O][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][=Branch1][Ring2][=C][Ring1][#Branch1][C][Branch1][C][N][=O] Penetration: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][Branch2][Ring1][#Branch2][C][Branch1][=Branch2][C][Branch1][Ring2][C][C][C][C][C][C][Branch1][O][N][C][=Branch1][C][=O][N][C][Ring1][=N][=O][=O][C] Penetration: You have to predict whether it has Penetration with answer Yes or No.

Yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically penetration/non-penetration to the brain-blood barrier, based on the SELFIE string representation of each molecule. You will be provided with several example molecules, each accompanied by a binary label indicating whether it has penetrative property (Yes) or not (No). Please answer with only Yes or No. SELFIE: [C][=C][C][=Branch2][Ring1][Ring1][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][Ring2][C][O][C][O][C][Ring1][Branch2][=O][O][C][C][=C][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][C][#N] Penetration: Yes SELFIE: [C@H1][N][Branch2][Ring2][Ring2][C@H1][Branch2][Ring1][O][C][C][Branch1][Ring2][C][Ring1][=Branch1][N][C][Branch1][#C][C][=C][C][=C][C][=Branch1][=Branch1][=C][Ring1][=Branch1][O][C][O][C][=O][C][C][Ring2][Ring1][Branch1][C][C][=C][C][=C][C][=C][Ring1][=Branch1] Penetration: Yes SELFIE: [C][C][Branch1][C][C][Branch1][C][C][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][Branch1][Ring1][C][O][=N][Ring1][=Branch2] Penetration: No SELFIE: [C][C][Branch1][O][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][=Branch1][Ring2][=C][Ring1][#Branch1][C][Branch1][C][N][=O] Penetration: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C@H1][C][Branch2][Ring1][N][C][=C][Branch1][=C][C][C@@H1][Ring1][=Branch1][C][C][N][Branch1][Ring2][C][Ring1][#Branch2][C][NH1][C][=Branch1][=Branch1][=C][Ring1][N][C][C][C][=O] Penetration: You have to predict whether it has Penetration with answer Yes or No.

Yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically penetration/non-penetration to the brain-blood barrier, based on the SELFIE string representation of each molecule. You will be provided with several example molecules, each accompanied by a binary label indicating whether it has penetrative property (Yes) or not (No). Please answer with only Yes or No. SELFIE: [C][=C][C][=Branch2][Ring1][Ring1][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][Ring2][C][O][C][O][C][Ring1][Branch2][=O][O][C][C][=C][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][C][#N] Penetration: Yes SELFIE: [C@H1][N][Branch2][Ring2][Ring2][C@H1][Branch2][Ring1][O][C][C][Branch1][Ring2][C][Ring1][=Branch1][N][C][Branch1][#C][C][=C][C][=C][C][=Branch1][=Branch1][=C][Ring1][=Branch1][O][C][O][C][=O][C][C][Ring2][Ring1][Branch1][C][C][=C][C][=C][C][=C][Ring1][=Branch1] Penetration: Yes SELFIE: [C][C][Branch1][C][C][Branch1][C][C][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][Branch1][Ring1][C][O][=N][Ring1][=Branch2] Penetration: No SELFIE: [C][C][Branch1][O][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][=Branch1][Ring2][=C][Ring1][#Branch1][C][Branch1][C][N][=O] Penetration: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [H+1].[C][=C][C][Branch2][Ring1][C][O][C][=Branch1][O][=N][C][Ring1][=Branch1][=C][C][=C][Ring1][#Branch2][Cl][N][C][C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C].[Cl-1] Penetration: You have to predict whether it has Penetration with answer Yes or No.

Yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically penetration/non-penetration to the brain-blood barrier, based on the SELFIE string representation of each molecule. You will be provided with several example molecules, each accompanied by a binary label indicating whether it has penetrative property (Yes) or not (No). Please answer with only Yes or No. SELFIE: [C][=C][C][=Branch2][Ring1][Ring1][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][Ring2][C][O][C][O][C][Ring1][Branch2][=O][O][C][C][=C][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][C][#N] Penetration: Yes SELFIE: [C@H1][N][Branch2][Ring2][Ring2][C@H1][Branch2][Ring1][O][C][C][Branch1][Ring2][C][Ring1][=Branch1][N][C][Branch1][#C][C][=C][C][=C][C][=Branch1][=Branch1][=C][Ring1][=Branch1][O][C][O][C][=O][C][C][Ring2][Ring1][Branch1][C][C][=C][C][=C][C][=C][Ring1][=Branch1] Penetration: Yes SELFIE: [C][C][Branch1][C][C][Branch1][C][C][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][Branch1][Ring1][C][O][=N][Ring1][=Branch2] Penetration: No SELFIE: [C][C][Branch1][O][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][=Branch1][Ring2][=C][Ring1][#Branch1][C][Branch1][C][N][=O] Penetration: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][=C][Branch1][C][Cl][C][=C][C][=C][Ring1][#Branch1][C][=Branch2][Ring1][Ring1][=N][C][Branch1][Branch2][C][=Branch1][C][=O][N][Ring1][Branch2][C][Branch1][Ring2][O][C][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][F] Penetration: You have to predict whether it has Penetration with answer Yes or No.

Yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically penetration/non-penetration to the brain-blood barrier, based on the SELFIE string representation of each molecule. You will be provided with several example molecules, each accompanied by a binary label indicating whether it has penetrative property (Yes) or not (No). Please answer with only Yes or No. SELFIE: [C][=C][C][=Branch2][Ring1][Ring1][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][Ring2][C][O][C][O][C][Ring1][Branch2][=O][O][C][C][=C][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][C][#N] Penetration: Yes SELFIE: [C@H1][N][Branch2][Ring2][Ring2][C@H1][Branch2][Ring1][O][C][C][Branch1][Ring2][C][Ring1][=Branch1][N][C][Branch1][#C][C][=C][C][=C][C][=Branch1][=Branch1][=C][Ring1][=Branch1][O][C][O][C][=O][C][C][Ring2][Ring1][Branch1][C][C][=C][C][=C][C][=C][Ring1][=Branch1] Penetration: Yes SELFIE: [C][C][Branch1][C][C][Branch1][C][C][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][Branch1][Ring1][C][O][=N][Ring1][=Branch2] Penetration: No SELFIE: [C][C][Branch1][O][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][=Branch1][Ring2][=C][Ring1][#Branch1][C][Branch1][C][N][=O] Penetration: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][=C][Branch1][N][N][C][C][N][Branch1][C][C][C][C][Ring1][#Branch1][N][=N][C][=C][Ring1][=N][N][Branch1][=C][C][=C][Branch1][Ring2][O][Ring1][=Branch1][C][=C][C][=C][Ring1][#Branch1][C] Penetration: You have to predict whether it has Penetration with answer Yes or No.

Yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically penetration/non-penetration to the brain-blood barrier, based on the SELFIE string representation of each molecule. You will be provided with several example molecules, each accompanied by a binary label indicating whether it has penetrative property (Yes) or not (No). Please answer with only Yes or No. SELFIE: [C][=C][C][=Branch2][Ring1][Ring1][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][Ring2][C][O][C][O][C][Ring1][Branch2][=O][O][C][C][=C][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][C][#N] Penetration: Yes SELFIE: [C@H1][N][Branch2][Ring2][Ring2][C@H1][Branch2][Ring1][O][C][C][Branch1][Ring2][C][Ring1][=Branch1][N][C][Branch1][#C][C][=C][C][=C][C][=Branch1][=Branch1][=C][Ring1][=Branch1][O][C][O][C][=O][C][C][Ring2][Ring1][Branch1][C][C][=C][C][=C][C][=C][Ring1][=Branch1] Penetration: Yes SELFIE: [C][C][Branch1][C][C][Branch1][C][C][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][Branch1][Ring1][C][O][=N][Ring1][=Branch2] Penetration: No SELFIE: [C][C][Branch1][O][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][=Branch1][Ring2][=C][Ring1][#Branch1][C][Branch1][C][N][=O] Penetration: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][=C][C][=Branch2][Ring1][Ring2][=C][C][=C][Ring1][=Branch1][\C][=C][\C][Branch1][=Branch2][N][C][C][C][C][C][Ring1][=Branch1][=O][O][C][O][Ring2][Ring1][C] Penetration: You have to predict whether it has Penetration with answer Yes or No.

Yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically penetration/non-penetration to the brain-blood barrier, based on the SELFIE string representation of each molecule. You will be provided with several example molecules, each accompanied by a binary label indicating whether it has penetrative property (Yes) or not (No). Please answer with only Yes or No. SELFIE: [C][=C][C][=Branch2][Ring1][Ring1][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][Ring2][C][O][C][O][C][Ring1][Branch2][=O][O][C][C][=C][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][C][#N] Penetration: Yes SELFIE: [C@H1][N][Branch2][Ring2][Ring2][C@H1][Branch2][Ring1][O][C][C][Branch1][Ring2][C][Ring1][=Branch1][N][C][Branch1][#C][C][=C][C][=C][C][=Branch1][=Branch1][=C][Ring1][=Branch1][O][C][O][C][=O][C][C][Ring2][Ring1][Branch1][C][C][=C][C][=C][C][=C][Ring1][=Branch1] Penetration: Yes SELFIE: [C][C][Branch1][C][C][Branch1][C][C][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][Branch1][Ring1][C][O][=N][Ring1][=Branch2] Penetration: No SELFIE: [C][C][Branch1][O][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][=Branch1][Ring2][=C][Ring1][#Branch1][C][Branch1][C][N][=O] Penetration: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][=C][C][=C][C][=C][Ring1][=Branch1][N][Branch1][#C][C][=C][Branch1][Branch1][C][C][Ring1][#Branch1][C][=C][C][=C][Ring1][Branch2][C][C][C][N][Branch1][C][C][C] Penetration: You have to predict whether it has Penetration with answer Yes or No.

Yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically penetration/non-penetration to the brain-blood barrier, based on the SELFIE string representation of each molecule. You will be provided with several example molecules, each accompanied by a binary label indicating whether it has penetrative property (Yes) or not (No). Please answer with only Yes or No. SELFIE: [C][=C][C][=Branch2][Ring1][Ring1][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][Ring2][C][O][C][O][C][Ring1][Branch2][=O][O][C][C][=C][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][C][#N] Penetration: Yes SELFIE: [C@H1][N][Branch2][Ring2][Ring2][C@H1][Branch2][Ring1][O][C][C][Branch1][Ring2][C][Ring1][=Branch1][N][C][Branch1][#C][C][=C][C][=C][C][=Branch1][=Branch1][=C][Ring1][=Branch1][O][C][O][C][=O][C][C][Ring2][Ring1][Branch1][C][C][=C][C][=C][C][=C][Ring1][=Branch1] Penetration: Yes SELFIE: [C][C][Branch1][C][C][Branch1][C][C][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][Branch1][Ring1][C][O][=N][Ring1][=Branch2] Penetration: No SELFIE: [C][C][Branch1][O][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][=Branch1][Ring2][=C][Ring1][#Branch1][C][Branch1][C][N][=O] Penetration: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][Branch2][Ring1][Ring2][N][C][Branch1][#C][C][Branch1][#Branch1][C][C][Branch1][C][C][C][N][C][Ring1][=Branch2][=S][=O][C][=C] Penetration: You have to predict whether it has Penetration with answer Yes or No.

Yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically penetration/non-penetration to the brain-blood barrier, based on the SELFIE string representation of each molecule. You will be provided with several example molecules, each accompanied by a binary label indicating whether it has penetrative property (Yes) or not (No). Please answer with only Yes or No. SELFIE: [C][=C][C][=Branch2][Ring1][Ring1][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][Ring2][C][O][C][O][C][Ring1][Branch2][=O][O][C][C][=C][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][C][#N] Penetration: Yes SELFIE: [C@H1][N][Branch2][Ring2][Ring2][C@H1][Branch2][Ring1][O][C][C][Branch1][Ring2][C][Ring1][=Branch1][N][C][Branch1][#C][C][=C][C][=C][C][=Branch1][=Branch1][=C][Ring1][=Branch1][O][C][O][C][=O][C][C][Ring2][Ring1][Branch1][C][C][=C][C][=C][C][=C][Ring1][=Branch1] Penetration: Yes SELFIE: [C][C][Branch1][C][C][Branch1][C][C][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][Branch1][Ring1][C][O][=N][Ring1][=Branch2] Penetration: No SELFIE: [C][C][Branch1][O][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][=Branch1][Ring2][=C][Ring1][#Branch1][C][Branch1][C][N][=O] Penetration: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][C][=C][C][=C][Branch1][C][C][C][=C][Ring1][#Branch1] Penetration: You have to predict whether it has Penetration with answer Yes or No.

Yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically penetration/non-penetration to the brain-blood barrier, based on the SELFIE string representation of each molecule. You will be provided with several example molecules, each accompanied by a binary label indicating whether it has penetrative property (Yes) or not (No). Please answer with only Yes or No. SELFIE: [C][=C][C][=Branch2][Ring1][Ring1][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][Ring2][C][O][C][O][C][Ring1][Branch2][=O][O][C][C][=C][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][C][#N] Penetration: Yes SELFIE: [C@H1][N][Branch2][Ring2][Ring2][C@H1][Branch2][Ring1][O][C][C][Branch1][Ring2][C][Ring1][=Branch1][N][C][Branch1][#C][C][=C][C][=C][C][=Branch1][=Branch1][=C][Ring1][=Branch1][O][C][O][C][=O][C][C][Ring2][Ring1][Branch1][C][C][=C][C][=C][C][=C][Ring1][=Branch1] Penetration: Yes SELFIE: [C][C][Branch1][C][C][Branch1][C][C][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][Branch1][Ring1][C][O][=N][Ring1][=Branch2] Penetration: No SELFIE: [C][C][Branch1][O][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][=Branch1][Ring2][=C][Ring1][#Branch1][C][Branch1][C][N][=O] Penetration: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][=C][C][=C][C][=C][Ring1][=Branch1][N][Branch2][Ring1][N][C][=C][Branch1][Ring2][S][Ring1][=Branch1][C][=C][C][=Branch1][Ring2][=C][Ring1][#Branch1][SH0][Branch1][=Branch1][N][Branch1][C][C][C][=Branch1][C][=O][=O][C][C][C][N][C][C][N][Branch1][Branch1][C][C][Ring1][=Branch1][C] Penetration: You have to predict whether it has Penetration with answer Yes or No.

Yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically penetration/non-penetration to the brain-blood barrier, based on the SELFIE string representation of each molecule. You will be provided with several example molecules, each accompanied by a binary label indicating whether it has penetrative property (Yes) or not (No). Please answer with only Yes or No. SELFIE: [C][=C][C][=Branch2][Ring1][Ring1][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][Ring2][C][O][C][O][C][Ring1][Branch2][=O][O][C][C][=C][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][C][#N] Penetration: Yes SELFIE: [C@H1][N][Branch2][Ring2][Ring2][C@H1][Branch2][Ring1][O][C][C][Branch1][Ring2][C][Ring1][=Branch1][N][C][Branch1][#C][C][=C][C][=C][C][=Branch1][=Branch1][=C][Ring1][=Branch1][O][C][O][C][=O][C][C][Ring2][Ring1][Branch1][C][C][=C][C][=C][C][=C][Ring1][=Branch1] Penetration: Yes SELFIE: [C][C][Branch1][C][C][Branch1][C][C][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][Branch1][Ring1][C][O][=N][Ring1][=Branch2] Penetration: No SELFIE: [C][C][Branch1][O][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][=Branch1][Ring2][=C][Ring1][#Branch1][C][Branch1][C][N][=O] Penetration: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C@@][Branch1][C][Cl][C][Branch2][Branch1][#C][C][=Branch1][#Branch2][=C][C][=Branch1][C][=O][C][=C][Ring1][#Branch1][C@@H1][Branch1][C][F][C][C][Ring1][=N][C][C][Branch2][Ring1][=N][C][Branch1][Branch2][C@@H1][Branch1][Ring2][C][Ring1][Branch1][C][C][=Branch1][C][=O][C][O][C][=Branch1][C][=O][C][Branch1][C][C][Branch1][C][C][C][Branch1][#Branch1][C][C][Ring2][Ring1][#C][O][C][C] Penetration: You have to predict whether it has Penetration with answer Yes or No.

Yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically penetration/non-penetration to the brain-blood barrier, based on the SELFIE string representation of each molecule. You will be provided with several example molecules, each accompanied by a binary label indicating whether it has penetrative property (Yes) or not (No). Please answer with only Yes or No. SELFIE: [C][=C][C][=Branch2][Ring1][Ring1][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][Ring2][C][O][C][O][C][Ring1][Branch2][=O][O][C][C][=C][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][C][#N] Penetration: Yes SELFIE: [C@H1][N][Branch2][Ring2][Ring2][C@H1][Branch2][Ring1][O][C][C][Branch1][Ring2][C][Ring1][=Branch1][N][C][Branch1][#C][C][=C][C][=C][C][=Branch1][=Branch1][=C][Ring1][=Branch1][O][C][O][C][=O][C][C][Ring2][Ring1][Branch1][C][C][=C][C][=C][C][=C][Ring1][=Branch1] Penetration: Yes SELFIE: [C][C][Branch1][C][C][Branch1][C][C][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][Branch1][Ring1][C][O][=N][Ring1][=Branch2] Penetration: No SELFIE: [C][C][Branch1][O][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][=Branch1][Ring2][=C][Ring1][#Branch1][C][Branch1][C][N][=O] Penetration: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][=N][C][=Branch1][S][=N][C][=C][Ring1][=Branch1][N][=C][NH0][Ring1][Branch1][C][O][C][C][O][N] Penetration: You have to predict whether it has Penetration with answer Yes or No.

Yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically penetration/non-penetration to the brain-blood barrier, based on the SELFIE string representation of each molecule. You will be provided with several example molecules, each accompanied by a binary label indicating whether it has penetrative property (Yes) or not (No). Please answer with only Yes or No. SELFIE: [C][=C][C][=Branch2][Ring1][Ring1][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][Ring2][C][O][C][O][C][Ring1][Branch2][=O][O][C][C][=C][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][C][#N] Penetration: Yes SELFIE: [C@H1][N][Branch2][Ring2][Ring2][C@H1][Branch2][Ring1][O][C][C][Branch1][Ring2][C][Ring1][=Branch1][N][C][Branch1][#C][C][=C][C][=C][C][=Branch1][=Branch1][=C][Ring1][=Branch1][O][C][O][C][=O][C][C][Ring2][Ring1][Branch1][C][C][=C][C][=C][C][=C][Ring1][=Branch1] Penetration: Yes SELFIE: [C][C][Branch1][C][C][Branch1][C][C][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][Branch1][Ring1][C][O][=N][Ring1][=Branch2] Penetration: No SELFIE: [C][C][Branch1][O][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][=Branch1][Ring2][=C][Ring1][#Branch1][C][Branch1][C][N][=O] Penetration: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [O][C][C][=C][C][=C][N][=C][Ring1][=Branch1] Penetration: You have to predict whether it has Penetration with answer Yes or No.

No

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically penetration/non-penetration to the brain-blood barrier, based on the SELFIE string representation of each molecule. You will be provided with several example molecules, each accompanied by a binary label indicating whether it has penetrative property (Yes) or not (No). Please answer with only Yes or No. SELFIE: [C][=C][C][=Branch2][Ring1][Ring1][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][Ring2][C][O][C][O][C][Ring1][Branch2][=O][O][C][C][=C][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][C][#N] Penetration: Yes SELFIE: [C@H1][N][Branch2][Ring2][Ring2][C@H1][Branch2][Ring1][O][C][C][Branch1][Ring2][C][Ring1][=Branch1][N][C][Branch1][#C][C][=C][C][=C][C][=Branch1][=Branch1][=C][Ring1][=Branch1][O][C][O][C][=O][C][C][Ring2][Ring1][Branch1][C][C][=C][C][=C][C][=C][Ring1][=Branch1] Penetration: Yes SELFIE: [C][C][Branch1][C][C][Branch1][C][C][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][Branch1][Ring1][C][O][=N][Ring1][=Branch2] Penetration: No SELFIE: [C][C][Branch1][O][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][=Branch1][Ring2][=C][Ring1][#Branch1][C][Branch1][C][N][=O] Penetration: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][C][C][N][Branch1][Branch1][C][C][Ring1][=Branch1][C][Branch1][Branch2][C][C][C][C][C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1] Penetration: You have to predict whether it has Penetration with answer Yes or No.

Yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically penetration/non-penetration to the brain-blood barrier, based on the SELFIE string representation of each molecule. You will be provided with several example molecules, each accompanied by a binary label indicating whether it has penetrative property (Yes) or not (No). Please answer with only Yes or No. SELFIE: [C][=C][C][=Branch2][Ring1][Ring1][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][Ring2][C][O][C][O][C][Ring1][Branch2][=O][O][C][C][=C][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][C][#N] Penetration: Yes SELFIE: [C@H1][N][Branch2][Ring2][Ring2][C@H1][Branch2][Ring1][O][C][C][Branch1][Ring2][C][Ring1][=Branch1][N][C][Branch1][#C][C][=C][C][=C][C][=Branch1][=Branch1][=C][Ring1][=Branch1][O][C][O][C][=O][C][C][Ring2][Ring1][Branch1][C][C][=C][C][=C][C][=C][Ring1][=Branch1] Penetration: Yes SELFIE: [C][C][Branch1][C][C][Branch1][C][C][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][Branch1][Ring1][C][O][=N][Ring1][=Branch2] Penetration: No SELFIE: [C][C][Branch1][O][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][=Branch1][Ring2][=C][Ring1][#Branch1][C][Branch1][C][N][=O] Penetration: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][C][Branch1][C][C][C][N][C][=Branch1][C][=O][C][Branch2][Branch2][=C][N][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][C][C][O][C][=C][Branch1][C][C][C][=Branch1][C][=O][C][=Branch2][#Branch1][C][=C][Branch2][=Branch1][C][C][=Branch1][C][=O][N][C][C][Branch1][C][C][O][C][=Branch1][C][=O][C][Branch1][=Branch1][C][Branch1][C][C][C][N][Branch1][C][C][C][=Branch1][C][=O][C][N][Branch1][C][C][C][=Branch1][C][=O][C][C][C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C][Branch1][#Branch1][N][C][Ring2][Ring1][=N][=O][C][Branch1][C][C][C][C][Ring2][Ring2][N][=N][C][Ring2][Branch1][Branch1][=Ring2][Ring2][S][N][C][Branch1][C][C][O][C][=Branch1][C][=O][C][Branch1][=Branch1][C][Branch1][C][C][C][N][Branch1][C][C][C][=Branch1][C][=O][C][N][Branch1][C][C][C][=Branch1][C][=O][C][C][C][C][N][Ring1][Branch1][C][Ring2][#Branch1][=Branch1][=O] Penetration: You have to predict whether it has Penetration with answer Yes or No.

No

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically penetration/non-penetration to the brain-blood barrier, based on the SELFIE string representation of each molecule. You will be provided with several example molecules, each accompanied by a binary label indicating whether it has penetrative property (Yes) or not (No). Please answer with only Yes or No. SELFIE: [C][=C][C][=Branch2][Ring1][Ring1][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][Ring2][C][O][C][O][C][Ring1][Branch2][=O][O][C][C][=C][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][C][#N] Penetration: Yes SELFIE: [C@H1][N][Branch2][Ring2][Ring2][C@H1][Branch2][Ring1][O][C][C][Branch1][Ring2][C][Ring1][=Branch1][N][C][Branch1][#C][C][=C][C][=C][C][=Branch1][=Branch1][=C][Ring1][=Branch1][O][C][O][C][=O][C][C][Ring2][Ring1][Branch1][C][C][=C][C][=C][C][=C][Ring1][=Branch1] Penetration: Yes SELFIE: [C][C][Branch1][C][C][Branch1][C][C][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][Branch1][Ring1][C][O][=N][Ring1][=Branch2] Penetration: No SELFIE: [C][C][Branch1][O][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][=Branch1][Ring2][=C][Ring1][#Branch1][C][Branch1][C][N][=O] Penetration: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C@H1][C@@H1][Branch1][#C][O][C][Branch1][#Branch2][C][Branch1][Ring1][C][C][Branch1][C][C][C][=O][C][C@@H1][Branch1][C][C][C][=C][Ring1][#C][C][=C][C@@H1][Branch2][Ring1][Branch1][C@@H1][Ring2][Ring1][Ring1][C][C][C@@H1][C][C@H1][Branch1][=Branch2][C][C][Branch1][Ring2][O][Ring1][=Branch1][=O][O][C] Penetration: You have to predict whether it has Penetration with answer Yes or No.

Yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically penetration/non-penetration to the brain-blood barrier, based on the SELFIE string representation of each molecule. You will be provided with several example molecules, each accompanied by a binary label indicating whether it has penetrative property (Yes) or not (No). Please answer with only Yes or No. SELFIE: [C][=C][C][=Branch2][Ring1][Ring1][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][Ring2][C][O][C][O][C][Ring1][Branch2][=O][O][C][C][=C][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][C][#N] Penetration: Yes SELFIE: [C@H1][N][Branch2][Ring2][Ring2][C@H1][Branch2][Ring1][O][C][C][Branch1][Ring2][C][Ring1][=Branch1][N][C][Branch1][#C][C][=C][C][=C][C][=Branch1][=Branch1][=C][Ring1][=Branch1][O][C][O][C][=O][C][C][Ring2][Ring1][Branch1][C][C][=C][C][=C][C][=C][Ring1][=Branch1] Penetration: Yes SELFIE: [C][C][Branch1][C][C][Branch1][C][C][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][Branch1][Ring1][C][O][=N][Ring1][=Branch2] Penetration: No SELFIE: [C][C][Branch1][O][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][=Branch1][Ring2][=C][Ring1][#Branch1][C][Branch1][C][N][=O] Penetration: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][=C][C][=C][C][=C][Ring1][=Branch1][C][Branch2][Ring1][=Branch1][N][Branch1][N][C][C][Branch1][#Branch1][N][C][C][C][Ring1][=Branch1][=O][SH0][Ring1][N][=Branch1][C][=O][=O][=O] Penetration: You have to predict whether it has Penetration with answer Yes or No.

Yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically penetration/non-penetration to the brain-blood barrier, based on the SELFIE string representation of each molecule. You will be provided with several example molecules, each accompanied by a binary label indicating whether it has penetrative property (Yes) or not (No). Please answer with only Yes or No. SELFIE: [C][=C][C][=Branch2][Ring1][Ring1][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][Ring2][C][O][C][O][C][Ring1][Branch2][=O][O][C][C][=C][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][C][#N] Penetration: Yes SELFIE: [C@H1][N][Branch2][Ring2][Ring2][C@H1][Branch2][Ring1][O][C][C][Branch1][Ring2][C][Ring1][=Branch1][N][C][Branch1][#C][C][=C][C][=C][C][=Branch1][=Branch1][=C][Ring1][=Branch1][O][C][O][C][=O][C][C][Ring2][Ring1][Branch1][C][C][=C][C][=C][C][=C][Ring1][=Branch1] Penetration: Yes SELFIE: [C][C][Branch1][C][C][Branch1][C][C][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][Branch1][Ring1][C][O][=N][Ring1][=Branch2] Penetration: No SELFIE: [C][C][Branch1][O][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][=Branch1][Ring2][=C][Ring1][#Branch1][C][Branch1][C][N][=O] Penetration: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][=C][Branch1][Ring1][C][#N][C][=C][C][=C][Ring1][Branch2][C][=C][Branch1][=C][C][=C][Branch1][#Branch1][C][=C][C][=C][Ring1][=Branch1][S][Ring1][O][C][C][N][Branch1][Branch1][C][C][Ring1][=C][C] Penetration: You have to predict whether it has Penetration with answer Yes or No.

Yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically penetration/non-penetration to the brain-blood barrier, based on the SELFIE string representation of each molecule. You will be provided with several example molecules, each accompanied by a binary label indicating whether it has penetrative property (Yes) or not (No). Please answer with only Yes or No. SELFIE: [C][=C][C][=Branch2][Ring1][Ring1][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][Ring2][C][O][C][O][C][Ring1][Branch2][=O][O][C][C][=C][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][C][#N] Penetration: Yes SELFIE: [C@H1][N][Branch2][Ring2][Ring2][C@H1][Branch2][Ring1][O][C][C][Branch1][Ring2][C][Ring1][=Branch1][N][C][Branch1][#C][C][=C][C][=C][C][=Branch1][=Branch1][=C][Ring1][=Branch1][O][C][O][C][=O][C][C][Ring2][Ring1][Branch1][C][C][=C][C][=C][C][=C][Ring1][=Branch1] Penetration: Yes SELFIE: [C][C][Branch1][C][C][Branch1][C][C][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][Branch1][Ring1][C][O][=N][Ring1][=Branch2] Penetration: No SELFIE: [C][C][Branch1][O][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][=Branch1][Ring2][=C][Ring1][#Branch1][C][Branch1][C][N][=O] Penetration: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][=Branch1][=C][=C][C][=C][Branch1][Branch2][C][=Branch1][Ring2][=C][Ring1][=Branch1][Cl][Cl][C][C][Branch2][Ring1][#Branch2][N][C@@H1][Branch1][=C][C][=C][Branch1][Branch1][C][C][Ring1][=Branch1][O][C][=C][Ring1][#Branch1][C][N][C][C][C][C][Ring1][Branch1][=O] Penetration: You have to predict whether it has Penetration with answer Yes or No.

Yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically penetration/non-penetration to the brain-blood barrier, based on the SELFIE string representation of each molecule. You will be provided with several example molecules, each accompanied by a binary label indicating whether it has penetrative property (Yes) or not (No). Please answer with only Yes or No. SELFIE: [C][=C][C][=Branch2][Ring1][Ring1][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][Ring2][C][O][C][O][C][Ring1][Branch2][=O][O][C][C][=C][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][C][#N] Penetration: Yes SELFIE: [C@H1][N][Branch2][Ring2][Ring2][C@H1][Branch2][Ring1][O][C][C][Branch1][Ring2][C][Ring1][=Branch1][N][C][Branch1][#C][C][=C][C][=C][C][=Branch1][=Branch1][=C][Ring1][=Branch1][O][C][O][C][=O][C][C][Ring2][Ring1][Branch1][C][C][=C][C][=C][C][=C][Ring1][=Branch1] Penetration: Yes SELFIE: [C][C][Branch1][C][C][Branch1][C][C][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][Branch1][Ring1][C][O][=N][Ring1][=Branch2] Penetration: No SELFIE: [C][C][Branch1][O][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][=Branch1][Ring2][=C][Ring1][#Branch1][C][Branch1][C][N][=O] Penetration: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [N][Branch1][=Branch1][C][=Branch1][C][=O][C][C][=C][C][=C][Branch1][C][O][C][=C][Ring1][#Branch1] Penetration: You have to predict whether it has Penetration with answer Yes or No.

Yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically penetration/non-penetration to the brain-blood barrier, based on the SELFIE string representation of each molecule. You will be provided with several example molecules, each accompanied by a binary label indicating whether it has penetrative property (Yes) or not (No). Please answer with only Yes or No. SELFIE: [C][=C][C][=Branch2][Ring1][Ring1][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][Ring2][C][O][C][O][C][Ring1][Branch2][=O][O][C][C][=C][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][C][#N] Penetration: Yes SELFIE: [C@H1][N][Branch2][Ring2][Ring2][C@H1][Branch2][Ring1][O][C][C][Branch1][Ring2][C][Ring1][=Branch1][N][C][Branch1][#C][C][=C][C][=C][C][=Branch1][=Branch1][=C][Ring1][=Branch1][O][C][O][C][=O][C][C][Ring2][Ring1][Branch1][C][C][=C][C][=C][C][=C][Ring1][=Branch1] Penetration: Yes SELFIE: [C][C][Branch1][C][C][Branch1][C][C][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][Branch1][Ring1][C][O][=N][Ring1][=Branch2] Penetration: No SELFIE: [C][C][Branch1][O][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][=Branch1][Ring2][=C][Ring1][#Branch1][C][Branch1][C][N][=O] Penetration: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][=C][Branch1][C][Cl][C][=C][C][=C][Ring1][#Branch1][C][=Branch1][P][=N][C][Branch1][C][O][C][Branch1][Branch2][N][Ring1][Branch2][C][C][C][#N][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][F] Penetration: You have to predict whether it has Penetration with answer Yes or No.

Yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically penetration/non-penetration to the brain-blood barrier, based on the SELFIE string representation of each molecule. You will be provided with several example molecules, each accompanied by a binary label indicating whether it has penetrative property (Yes) or not (No). Please answer with only Yes or No. SELFIE: [C][=C][C][=Branch2][Ring1][Ring1][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][Ring2][C][O][C][O][C][Ring1][Branch2][=O][O][C][C][=C][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][C][#N] Penetration: Yes SELFIE: [C@H1][N][Branch2][Ring2][Ring2][C@H1][Branch2][Ring1][O][C][C][Branch1][Ring2][C][Ring1][=Branch1][N][C][Branch1][#C][C][=C][C][=C][C][=Branch1][=Branch1][=C][Ring1][=Branch1][O][C][O][C][=O][C][C][Ring2][Ring1][Branch1][C][C][=C][C][=C][C][=C][Ring1][=Branch1] Penetration: Yes SELFIE: [C][C][Branch1][C][C][Branch1][C][C][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][Branch1][Ring1][C][O][=N][Ring1][=Branch2] Penetration: No SELFIE: [C][C][Branch1][O][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][=Branch1][Ring2][=C][Ring1][#Branch1][C][Branch1][C][N][=O] Penetration: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][=C][C][=Branch2][Ring2][C][=C][C][=C][Ring1][=Branch1][C][Branch1][N][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][Branch1][Branch1][O][C][Ring1][N][C][C][C][N][Branch1][C][C][C][C][#N] Penetration: You have to predict whether it has Penetration with answer Yes or No.

Yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically penetration/non-penetration to the brain-blood barrier, based on the SELFIE string representation of each molecule. You will be provided with several example molecules, each accompanied by a binary label indicating whether it has penetrative property (Yes) or not (No). Please answer with only Yes or No. SELFIE: [C][=C][C][=Branch2][Ring1][Ring1][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][Ring2][C][O][C][O][C][Ring1][Branch2][=O][O][C][C][=C][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][C][#N] Penetration: Yes SELFIE: [C@H1][N][Branch2][Ring2][Ring2][C@H1][Branch2][Ring1][O][C][C][Branch1][Ring2][C][Ring1][=Branch1][N][C][Branch1][#C][C][=C][C][=C][C][=Branch1][=Branch1][=C][Ring1][=Branch1][O][C][O][C][=O][C][C][Ring2][Ring1][Branch1][C][C][=C][C][=C][C][=C][Ring1][=Branch1] Penetration: Yes SELFIE: [C][C][Branch1][C][C][Branch1][C][C][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][Branch1][Ring1][C][O][=N][Ring1][=Branch2] Penetration: No SELFIE: [C][C][Branch1][O][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][=Branch1][Ring2][=C][Ring1][#Branch1][C][Branch1][C][N][=O] Penetration: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C@][Branch2][=Branch1][Branch1][C@H1][Branch2][Ring2][Ring2][C@H1][C@][Branch2][Ring1][Branch1][C@@][Branch1][P][C][=Branch1][#Branch2][=C][C][=Branch1][C][=O][C][=C][Ring1][#Branch1][C][C][Ring1][O][C][Branch1][C][F][C@H1][Branch1][Ring2][C][Ring1][P][O][C][C@H1][Branch2][Ring1][Ring1][C@@][Ring2][Ring1][Branch1][Branch1][N][C][Branch1][Branch2][C][O][C][Branch1][C][C][=O][=O][O][O][C][Branch1][C][C][=O][C] Penetration: You have to predict whether it has Penetration with answer Yes or No.

Yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically penetration/non-penetration to the brain-blood barrier, based on the SELFIE string representation of each molecule. You will be provided with several example molecules, each accompanied by a binary label indicating whether it has penetrative property (Yes) or not (No). Please answer with only Yes or No. SELFIE: [C][=C][C][=Branch2][Ring1][Ring1][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][Ring2][C][O][C][O][C][Ring1][Branch2][=O][O][C][C][=C][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][C][#N] Penetration: Yes SELFIE: [C@H1][N][Branch2][Ring2][Ring2][C@H1][Branch2][Ring1][O][C][C][Branch1][Ring2][C][Ring1][=Branch1][N][C][Branch1][#C][C][=C][C][=C][C][=Branch1][=Branch1][=C][Ring1][=Branch1][O][C][O][C][=O][C][C][Ring2][Ring1][Branch1][C][C][=C][C][=C][C][=C][Ring1][=Branch1] Penetration: Yes SELFIE: [C][C][Branch1][C][C][Branch1][C][C][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][Branch1][Ring1][C][O][=N][Ring1][=Branch2] Penetration: No SELFIE: [C][C][Branch1][O][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][=Branch1][Ring2][=C][Ring1][#Branch1][C][Branch1][C][N][=O] Penetration: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][Branch1][N][C][Branch1][Ring2][C][C][C][C][Branch1][C][N][=O][C][C] Penetration: You have to predict whether it has Penetration with answer Yes or No.

Yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically penetration/non-penetration to the brain-blood barrier, based on the SELFIE string representation of each molecule. You will be provided with several example molecules, each accompanied by a binary label indicating whether it has penetrative property (Yes) or not (No). Please answer with only Yes or No. SELFIE: [C][=C][C][=Branch2][Ring1][Ring1][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][Ring2][C][O][C][O][C][Ring1][Branch2][=O][O][C][C][=C][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][C][#N] Penetration: Yes SELFIE: [C@H1][N][Branch2][Ring2][Ring2][C@H1][Branch2][Ring1][O][C][C][Branch1][Ring2][C][Ring1][=Branch1][N][C][Branch1][#C][C][=C][C][=C][C][=Branch1][=Branch1][=C][Ring1][=Branch1][O][C][O][C][=O][C][C][Ring2][Ring1][Branch1][C][C][=C][C][=C][C][=C][Ring1][=Branch1] Penetration: Yes SELFIE: [C][C][Branch1][C][C][Branch1][C][C][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][Branch1][Ring1][C][O][=N][Ring1][=Branch2] Penetration: No SELFIE: [C][C][Branch1][O][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][=Branch1][Ring2][=C][Ring1][#Branch1][C][Branch1][C][N][=O] Penetration: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][C][Branch1][C][C][C][C][C][=Branch1][C][=O][N][C][Branch2][=Branch2][Branch1][C][=Branch1][C][=O][N][C][C][C][C][Ring1][Branch1][C][=Branch1][C][=O][N][C][Branch2][#Branch1][N][C][=Branch1][C][=O][N][C][Branch2][=Branch1][#C][C][=Branch1][C][=O][N][C][Branch2][Branch1][S][C][=Branch1][C][=O][N][C][Branch2][Ring2][=C][C][=Branch1][C][=O][N][C][C][C][C][Ring1][Branch1][C][=Branch1][C][=O][N][C][Branch2][Ring1][Branch1][C][=Branch1][C][=O][N][C][Branch1][=Branch2][C][=Branch1][C][=O][N][Ring2][Ring2][=C][C][C][C][N][C][Branch1][C][C][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][Branch1][C][C][C][C][C][C][N][C][Branch1][C][C][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1] Penetration: You have to predict whether it has Penetration with answer Yes or No.

No

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically penetration/non-penetration to the brain-blood barrier, based on the SELFIE string representation of each molecule. You will be provided with several example molecules, each accompanied by a binary label indicating whether it has penetrative property (Yes) or not (No). Please answer with only Yes or No. SELFIE: [C][=C][C][=Branch2][Ring1][Ring1][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][Ring2][C][O][C][O][C][Ring1][Branch2][=O][O][C][C][=C][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][C][#N] Penetration: Yes SELFIE: [C@H1][N][Branch2][Ring2][Ring2][C@H1][Branch2][Ring1][O][C][C][Branch1][Ring2][C][Ring1][=Branch1][N][C][Branch1][#C][C][=C][C][=C][C][=Branch1][=Branch1][=C][Ring1][=Branch1][O][C][O][C][=O][C][C][Ring2][Ring1][Branch1][C][C][=C][C][=C][C][=C][Ring1][=Branch1] Penetration: Yes SELFIE: [C][C][Branch1][C][C][Branch1][C][C][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][Branch1][Ring1][C][O][=N][Ring1][=Branch2] Penetration: No SELFIE: [C][C][Branch1][O][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][=Branch1][Ring2][=C][Ring1][#Branch1][C][Branch1][C][N][=O] Penetration: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][C@H1][Branch1][Branch2][C][C][C][Branch1][C][O][=O][C@H1][C][C][C@H1][C@H1][C@H1][Branch1][N][C][C][=Branch1][C][=O][C@][Ring1][#Branch2][Ring1][#Branch1][C][C@@][Branch1][C][C][C][C][C][=Branch1][C][=O][C][C@H1][Ring1][Branch2][C][C][Ring1][P][=O] Penetration: You have to predict whether it has Penetration with answer Yes or No.

No

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically penetration/non-penetration to the brain-blood barrier, based on the SELFIE string representation of each molecule. You will be provided with several example molecules, each accompanied by a binary label indicating whether it has penetrative property (Yes) or not (No). Please answer with only Yes or No. SELFIE: [C][=C][C][=Branch2][Ring1][Ring1][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][Ring2][C][O][C][O][C][Ring1][Branch2][=O][O][C][C][=C][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][C][#N] Penetration: Yes SELFIE: [C@H1][N][Branch2][Ring2][Ring2][C@H1][Branch2][Ring1][O][C][C][Branch1][Ring2][C][Ring1][=Branch1][N][C][Branch1][#C][C][=C][C][=C][C][=Branch1][=Branch1][=C][Ring1][=Branch1][O][C][O][C][=O][C][C][Ring2][Ring1][Branch1][C][C][=C][C][=C][C][=C][Ring1][=Branch1] Penetration: Yes SELFIE: [C][C][Branch1][C][C][Branch1][C][C][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][Branch1][Ring1][C][O][=N][Ring1][=Branch2] Penetration: No SELFIE: [C][C][Branch1][O][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][=Branch1][Ring2][=C][Ring1][#Branch1][C][Branch1][C][N][=O] Penetration: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][=N][C][Branch2][Ring1][Branch2][C][C][C][N][Branch1][Branch1][C][C][Ring1][=Branch1][C][Branch1][#Branch2][N][C][C][C][C][C][C][Ring1][=Branch1][=S][=C][NH1][Ring2][Ring1][Ring2] Penetration: You have to predict whether it has Penetration with answer Yes or No.

Yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically penetration/non-penetration to the brain-blood barrier, based on the SELFIE string representation of each molecule. You will be provided with several example molecules, each accompanied by a binary label indicating whether it has penetrative property (Yes) or not (No). Please answer with only Yes or No. SELFIE: [C][=C][C][=Branch2][Ring1][Ring1][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][Ring2][C][O][C][O][C][Ring1][Branch2][=O][O][C][C][=C][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][C][#N] Penetration: Yes SELFIE: [C@H1][N][Branch2][Ring2][Ring2][C@H1][Branch2][Ring1][O][C][C][Branch1][Ring2][C][Ring1][=Branch1][N][C][Branch1][#C][C][=C][C][=C][C][=Branch1][=Branch1][=C][Ring1][=Branch1][O][C][O][C][=O][C][C][Ring2][Ring1][Branch1][C][C][=C][C][=C][C][=C][Ring1][=Branch1] Penetration: Yes SELFIE: [C][C][Branch1][C][C][Branch1][C][C][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][Branch1][Ring1][C][O][=N][Ring1][=Branch2] Penetration: No SELFIE: [C][C][Branch1][O][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][=Branch1][Ring2][=C][Ring1][#Branch1][C][Branch1][C][N][=O] Penetration: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][C][=Branch1][C][=O][O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Branch1][C][O][=O] Penetration: You have to predict whether it has Penetration with answer Yes or No.

No

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically penetration/non-penetration to the brain-blood barrier, based on the SELFIE string representation of each molecule. You will be provided with several example molecules, each accompanied by a binary label indicating whether it has penetrative property (Yes) or not (No). Please answer with only Yes or No. SELFIE: [C][=C][C][=Branch2][Ring1][Ring1][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][Ring2][C][O][C][O][C][Ring1][Branch2][=O][O][C][C][=C][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][C][#N] Penetration: Yes SELFIE: [C@H1][N][Branch2][Ring2][Ring2][C@H1][Branch2][Ring1][O][C][C][Branch1][Ring2][C][Ring1][=Branch1][N][C][Branch1][#C][C][=C][C][=C][C][=Branch1][=Branch1][=C][Ring1][=Branch1][O][C][O][C][=O][C][C][Ring2][Ring1][Branch1][C][C][=C][C][=C][C][=C][Ring1][=Branch1] Penetration: Yes SELFIE: [C][C][Branch1][C][C][Branch1][C][C][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][Branch1][Ring1][C][O][=N][Ring1][=Branch2] Penetration: No SELFIE: [C][C][Branch1][O][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][=Branch1][Ring2][=C][Ring1][#Branch1][C][Branch1][C][N][=O] Penetration: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][O][C][=Branch1][C][=O][C][Branch1][=Branch2][C][C][C][C][C][N][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1] Penetration: You have to predict whether it has Penetration with answer Yes or No.

Yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically penetration/non-penetration to the brain-blood barrier, based on the SELFIE string representation of each molecule. You will be provided with several example molecules, each accompanied by a binary label indicating whether it has penetrative property (Yes) or not (No). Please answer with only Yes or No. SELFIE: [C][=C][C][=Branch2][Ring1][Ring1][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][Ring2][C][O][C][O][C][Ring1][Branch2][=O][O][C][C][=C][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][C][#N] Penetration: Yes SELFIE: [C@H1][N][Branch2][Ring2][Ring2][C@H1][Branch2][Ring1][O][C][C][Branch1][Ring2][C][Ring1][=Branch1][N][C][Branch1][#C][C][=C][C][=C][C][=Branch1][=Branch1][=C][Ring1][=Branch1][O][C][O][C][=O][C][C][Ring2][Ring1][Branch1][C][C][=C][C][=C][C][=C][Ring1][=Branch1] Penetration: Yes SELFIE: [C][C][Branch1][C][C][Branch1][C][C][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][Branch1][Ring1][C][O][=N][Ring1][=Branch2] Penetration: No SELFIE: [C][C][Branch1][O][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][=Branch1][Ring2][=C][Ring1][#Branch1][C][Branch1][C][N][=O] Penetration: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][C][=C][Branch2][Ring2][=Branch2][N][C@H1][Branch1][Branch1][S][C][Ring1][=Branch1][C@H1][Branch2][Ring1][Branch2][N][C][=Branch1][C][=O][C@H1][Branch1][C][N][C][=C][C][=C][Branch1][C][O][C][Branch1][C][Cl][=C][Ring1][Branch2][C][Ring2][Ring1][Ring1][=O][C][Branch1][C][O][=O] Penetration: You have to predict whether it has Penetration with answer Yes or No.

No

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically penetration/non-penetration to the brain-blood barrier, based on the SELFIE string representation of each molecule. You will be provided with several example molecules, each accompanied by a binary label indicating whether it has penetrative property (Yes) or not (No). Please answer with only Yes or No. SELFIE: [C][=C][C][=Branch2][Ring1][Ring1][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][Ring2][C][O][C][O][C][Ring1][Branch2][=O][O][C][C][=C][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][C][#N] Penetration: Yes SELFIE: [C@H1][N][Branch2][Ring2][Ring2][C@H1][Branch2][Ring1][O][C][C][Branch1][Ring2][C][Ring1][=Branch1][N][C][Branch1][#C][C][=C][C][=C][C][=Branch1][=Branch1][=C][Ring1][=Branch1][O][C][O][C][=O][C][C][Ring2][Ring1][Branch1][C][C][=C][C][=C][C][=C][Ring1][=Branch1] Penetration: Yes SELFIE: [C][C][Branch1][C][C][Branch1][C][C][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][Branch1][Ring1][C][O][=N][Ring1][=Branch2] Penetration: No SELFIE: [C][C][Branch1][O][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][=Branch1][Ring2][=C][Ring1][#Branch1][C][Branch1][C][N][=O] Penetration: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [O][C][Branch1][=Branch2][C][N][C][=N][C][=N][Ring1][Branch1][Branch1][=Branch2][C][N][C][=N][C][=N][Ring1][Branch1][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][F] Penetration: You have to predict whether it has Penetration with answer Yes or No.

Yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically penetration/non-penetration to the brain-blood barrier, based on the SELFIE string representation of each molecule. You will be provided with several example molecules, each accompanied by a binary label indicating whether it has penetrative property (Yes) or not (No). Please answer with only Yes or No. SELFIE: [C][=C][C][=Branch2][Ring1][Ring1][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][Ring2][C][O][C][O][C][Ring1][Branch2][=O][O][C][C][=C][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][C][#N] Penetration: Yes SELFIE: [C@H1][N][Branch2][Ring2][Ring2][C@H1][Branch2][Ring1][O][C][C][Branch1][Ring2][C][Ring1][=Branch1][N][C][Branch1][#C][C][=C][C][=C][C][=Branch1][=Branch1][=C][Ring1][=Branch1][O][C][O][C][=O][C][C][Ring2][Ring1][Branch1][C][C][=C][C][=C][C][=C][Ring1][=Branch1] Penetration: Yes SELFIE: [C][C][Branch1][C][C][Branch1][C][C][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][Branch1][Ring1][C][O][=N][Ring1][=Branch2] Penetration: No SELFIE: [C][C][Branch1][O][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][=Branch1][Ring2][=C][Ring1][#Branch1][C][Branch1][C][N][=O] Penetration: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][C@][Branch1][C][O][C][C][C@H1][C@@H1][C][C][C@H1][C][C][=Branch1][C][=O][O][C][C@][Ring1][#Branch1][Branch1][C][C][C@H1][Ring1][N][C][C][C@][Ring2][Ring1][Ring2][Ring1][S][C] Penetration: You have to predict whether it has Penetration with answer Yes or No.

No

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically penetration/non-penetration to the brain-blood barrier, based on the SELFIE string representation of each molecule. You will be provided with several example molecules, each accompanied by a binary label indicating whether it has penetrative property (Yes) or not (No). Please answer with only Yes or No. SELFIE: [C][=C][C][=Branch2][Ring1][Ring1][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][Ring2][C][O][C][O][C][Ring1][Branch2][=O][O][C][C][=C][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][C][#N] Penetration: Yes SELFIE: [C@H1][N][Branch2][Ring2][Ring2][C@H1][Branch2][Ring1][O][C][C][Branch1][Ring2][C][Ring1][=Branch1][N][C][Branch1][#C][C][=C][C][=C][C][=Branch1][=Branch1][=C][Ring1][=Branch1][O][C][O][C][=O][C][C][Ring2][Ring1][Branch1][C][C][=C][C][=C][C][=C][Ring1][=Branch1] Penetration: Yes SELFIE: [C][C][Branch1][C][C][Branch1][C][C][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][Branch1][Ring1][C][O][=N][Ring1][=Branch2] Penetration: No SELFIE: [C][C][Branch1][O][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][=Branch1][Ring2][=C][Ring1][#Branch1][C][Branch1][C][N][=O] Penetration: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][=C][Branch1][#C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][N][C][Branch1][C][C][=O][O][C][Branch1][C][C][Branch1][C][C][C] Penetration: You have to predict whether it has Penetration with answer Yes or No.

Yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically penetration/non-penetration to the brain-blood barrier, based on the SELFIE string representation of each molecule. You will be provided with several example molecules, each accompanied by a binary label indicating whether it has penetrative property (Yes) or not (No). Please answer with only Yes or No. SELFIE: [C][=C][C][=Branch2][Ring1][Ring1][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][Ring2][C][O][C][O][C][Ring1][Branch2][=O][O][C][C][=C][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][C][#N] Penetration: Yes SELFIE: [C@H1][N][Branch2][Ring2][Ring2][C@H1][Branch2][Ring1][O][C][C][Branch1][Ring2][C][Ring1][=Branch1][N][C][Branch1][#C][C][=C][C][=C][C][=Branch1][=Branch1][=C][Ring1][=Branch1][O][C][O][C][=O][C][C][Ring2][Ring1][Branch1][C][C][=C][C][=C][C][=C][Ring1][=Branch1] Penetration: Yes SELFIE: [C][C][Branch1][C][C][Branch1][C][C][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][Branch1][Ring1][C][O][=N][Ring1][=Branch2] Penetration: No SELFIE: [C][C][Branch1][O][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][=Branch1][Ring2][=C][Ring1][#Branch1][C][Branch1][C][N][=O] Penetration: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][=C][Branch1][Ring1][C][#N][C][=C][C][=C][Ring1][Branch2][N][Branch1][=C][C][=C][Branch1][#Branch1][C][=C][C][=C][Ring1][=Branch1][S][Ring1][#Branch2][C][C][Branch1][#Branch1][C][N][Branch1][C][C][C][C] Penetration: You have to predict whether it has Penetration with answer Yes or No.

Yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically penetration/non-penetration to the brain-blood barrier, based on the SELFIE string representation of each molecule. You will be provided with several example molecules, each accompanied by a binary label indicating whether it has penetrative property (Yes) or not (No). Please answer with only Yes or No. SELFIE: [C][=C][C][=Branch2][Ring1][Ring1][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][Ring2][C][O][C][O][C][Ring1][Branch2][=O][O][C][C][=C][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][C][#N] Penetration: Yes SELFIE: [C@H1][N][Branch2][Ring2][Ring2][C@H1][Branch2][Ring1][O][C][C][Branch1][Ring2][C][Ring1][=Branch1][N][C][Branch1][#C][C][=C][C][=C][C][=Branch1][=Branch1][=C][Ring1][=Branch1][O][C][O][C][=O][C][C][Ring2][Ring1][Branch1][C][C][=C][C][=C][C][=C][Ring1][=Branch1] Penetration: Yes SELFIE: [C][C][Branch1][C][C][Branch1][C][C][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][Branch1][Ring1][C][O][=N][Ring1][=Branch2] Penetration: No SELFIE: [C][C][Branch1][O][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][=Branch1][Ring2][=C][Ring1][#Branch1][C][Branch1][C][N][=O] Penetration: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][=C][Branch2][Ring1][=C][C][=Branch1][#Branch1][=C][C][=C][Ring1][=Branch1][Cl][N][Branch1][P][C][Branch1][=N][C][N][Branch1][Branch2][C][Branch1][Ring2][C][C][#N][C][C][=O][C][C][Branch1][N][C][=C][Branch1][#Branch1][C][=C][C][=C][Ring1][=Branch1][F][=O] Penetration: You have to predict whether it has Penetration with answer Yes or No.

Yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically penetration/non-penetration to the brain-blood barrier, based on the SELFIE string representation of each molecule. You will be provided with several example molecules, each accompanied by a binary label indicating whether it has penetrative property (Yes) or not (No). Please answer with only Yes or No. SELFIE: [C][=C][C][=Branch2][Ring1][Ring1][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][Ring2][C][O][C][O][C][Ring1][Branch2][=O][O][C][C][=C][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][C][#N] Penetration: Yes SELFIE: [C@H1][N][Branch2][Ring2][Ring2][C@H1][Branch2][Ring1][O][C][C][Branch1][Ring2][C][Ring1][=Branch1][N][C][Branch1][#C][C][=C][C][=C][C][=Branch1][=Branch1][=C][Ring1][=Branch1][O][C][O][C][=O][C][C][Ring2][Ring1][Branch1][C][C][=C][C][=C][C][=C][Ring1][=Branch1] Penetration: Yes SELFIE: [C][C][Branch1][C][C][Branch1][C][C][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][Branch1][Ring1][C][O][=N][Ring1][=Branch2] Penetration: No SELFIE: [C][C][Branch1][O][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][=Branch1][Ring2][=C][Ring1][#Branch1][C][Branch1][C][N][=O] Penetration: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][Branch1][Ring1][C][Cl][Branch1][C][F][Branch1][C][F][F] Penetration: You have to predict whether it has Penetration with answer Yes or No.

Yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically penetration/non-penetration to the brain-blood barrier, based on the SELFIE string representation of each molecule. You will be provided with several example molecules, each accompanied by a binary label indicating whether it has penetrative property (Yes) or not (No). Please answer with only Yes or No. SELFIE: [C][=C][C][=Branch2][Ring1][Ring1][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][Ring2][C][O][C][O][C][Ring1][Branch2][=O][O][C][C][=C][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][C][#N] Penetration: Yes SELFIE: [C@H1][N][Branch2][Ring2][Ring2][C@H1][Branch2][Ring1][O][C][C][Branch1][Ring2][C][Ring1][=Branch1][N][C][Branch1][#C][C][=C][C][=C][C][=Branch1][=Branch1][=C][Ring1][=Branch1][O][C][O][C][=O][C][C][Ring2][Ring1][Branch1][C][C][=C][C][=C][C][=C][Ring1][=Branch1] Penetration: Yes SELFIE: [C][C][Branch1][C][C][Branch1][C][C][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][Branch1][Ring1][C][O][=N][Ring1][=Branch2] Penetration: No SELFIE: [C][C][Branch1][O][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][=Branch1][Ring2][=C][Ring1][#Branch1][C][Branch1][C][N][=O] Penetration: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][C][Branch1][C][C][C][C][=C][C][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][C][Branch1][C][C][C][Branch1][C][O][=O] Penetration: You have to predict whether it has Penetration with answer Yes or No.

No

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically penetration/non-penetration to the brain-blood barrier, based on the SELFIE string representation of each molecule. You will be provided with several example molecules, each accompanied by a binary label indicating whether it has penetrative property (Yes) or not (No). Please answer with only Yes or No. SELFIE: [C][=C][C][=Branch2][Ring1][Ring1][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][Ring2][C][O][C][O][C][Ring1][Branch2][=O][O][C][C][=C][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][C][#N] Penetration: Yes SELFIE: [C@H1][N][Branch2][Ring2][Ring2][C@H1][Branch2][Ring1][O][C][C][Branch1][Ring2][C][Ring1][=Branch1][N][C][Branch1][#C][C][=C][C][=C][C][=Branch1][=Branch1][=C][Ring1][=Branch1][O][C][O][C][=O][C][C][Ring2][Ring1][Branch1][C][C][=C][C][=C][C][=C][Ring1][=Branch1] Penetration: Yes SELFIE: [C][C][Branch1][C][C][Branch1][C][C][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][Branch1][Ring1][C][O][=N][Ring1][=Branch2] Penetration: No SELFIE: [C][C][Branch1][O][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][=Branch1][Ring2][=C][Ring1][#Branch1][C][Branch1][C][N][=O] Penetration: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][=C][C][=C][C][=C][Ring1][=Branch1][C][Branch2][Ring1][=Branch1][N][Branch1][#Branch1][C][C][Branch1][C][O][=O][C][Branch1][=Branch2][C][Ring1][#Branch2][=C][C][=C][Ring1][=C][=O][=O] Penetration: You have to predict whether it has Penetration with answer Yes or No.

Yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically penetration/non-penetration to the brain-blood barrier, based on the SELFIE string representation of each molecule. You will be provided with several example molecules, each accompanied by a binary label indicating whether it has penetrative property (Yes) or not (No). Please answer with only Yes or No. SELFIE: [C][=C][C][=Branch2][Ring1][Ring1][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][Ring2][C][O][C][O][C][Ring1][Branch2][=O][O][C][C][=C][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][C][#N] Penetration: Yes SELFIE: [C@H1][N][Branch2][Ring2][Ring2][C@H1][Branch2][Ring1][O][C][C][Branch1][Ring2][C][Ring1][=Branch1][N][C][Branch1][#C][C][=C][C][=C][C][=Branch1][=Branch1][=C][Ring1][=Branch1][O][C][O][C][=O][C][C][Ring2][Ring1][Branch1][C][C][=C][C][=C][C][=C][Ring1][=Branch1] Penetration: Yes SELFIE: [C][C][Branch1][C][C][Branch1][C][C][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][Branch1][Ring1][C][O][=N][Ring1][=Branch2] Penetration: No SELFIE: [C][C][Branch1][O][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][=Branch1][Ring2][=C][Ring1][#Branch1][C][Branch1][C][N][=O] Penetration: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][Branch2][Ring1][#Branch1][C][Branch2][Ring1][C][C][Branch1][C][C][Branch1][C][C][C][Branch1][Ring2][C][Ring1][#Branch1][C][C][Ring1][Branch2][C][O][C][C][N][Branch1][C][C][C] Penetration: You have to predict whether it has Penetration with answer Yes or No.

Yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically penetration/non-penetration to the brain-blood barrier, based on the SELFIE string representation of each molecule. You will be provided with several example molecules, each accompanied by a binary label indicating whether it has penetrative property (Yes) or not (No). Please answer with only Yes or No. SELFIE: [C][=C][C][=Branch2][Ring1][Ring1][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][Ring2][C][O][C][O][C][Ring1][Branch2][=O][O][C][C][=C][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][C][#N] Penetration: Yes SELFIE: [C@H1][N][Branch2][Ring2][Ring2][C@H1][Branch2][Ring1][O][C][C][Branch1][Ring2][C][Ring1][=Branch1][N][C][Branch1][#C][C][=C][C][=C][C][=Branch1][=Branch1][=C][Ring1][=Branch1][O][C][O][C][=O][C][C][Ring2][Ring1][Branch1][C][C][=C][C][=C][C][=C][Ring1][=Branch1] Penetration: Yes SELFIE: [C][C][Branch1][C][C][Branch1][C][C][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][Branch1][Ring1][C][O][=N][Ring1][=Branch2] Penetration: No SELFIE: [C][C][Branch1][O][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][=Branch1][Ring2][=C][Ring1][#Branch1][C][Branch1][C][N][=O] Penetration: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][=C][C][=Branch2][Ring1][=N][=C][C][=C][Ring1][=Branch1][C][Branch1][=N][N][C][C][N][Branch1][C][C][C][C][C][Ring1][Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][Cl] Penetration: You have to predict whether it has Penetration with answer Yes or No.

Yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically penetration/non-penetration to the brain-blood barrier, based on the SELFIE string representation of each molecule. You will be provided with several example molecules, each accompanied by a binary label indicating whether it has penetrative property (Yes) or not (No). Please answer with only Yes or No. SELFIE: [C][=C][C][=Branch2][Ring1][Ring1][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][Ring2][C][O][C][O][C][Ring1][Branch2][=O][O][C][C][=C][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][C][#N] Penetration: Yes SELFIE: [C@H1][N][Branch2][Ring2][Ring2][C@H1][Branch2][Ring1][O][C][C][Branch1][Ring2][C][Ring1][=Branch1][N][C][Branch1][#C][C][=C][C][=C][C][=Branch1][=Branch1][=C][Ring1][=Branch1][O][C][O][C][=O][C][C][Ring2][Ring1][Branch1][C][C][=C][C][=C][C][=C][Ring1][=Branch1] Penetration: Yes SELFIE: [C][C][Branch1][C][C][Branch1][C][C][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][Branch1][Ring1][C][O][=N][Ring1][=Branch2] Penetration: No SELFIE: [C][C][Branch1][O][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][=Branch1][Ring2][=C][Ring1][#Branch1][C][Branch1][C][N][=O] Penetration: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [N][=C][Branch1][=Branch1][S][C][=C][Ring1][Branch1][C][C][N] Penetration: You have to predict whether it has Penetration with answer Yes or No.

Yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically penetration/non-penetration to the brain-blood barrier, based on the SELFIE string representation of each molecule. You will be provided with several example molecules, each accompanied by a binary label indicating whether it has penetrative property (Yes) or not (No). Please answer with only Yes or No. SELFIE: [C][=C][C][=Branch2][Ring1][Ring1][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][Ring2][C][O][C][O][C][Ring1][Branch2][=O][O][C][C][=C][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][C][#N] Penetration: Yes SELFIE: [C@H1][N][Branch2][Ring2][Ring2][C@H1][Branch2][Ring1][O][C][C][Branch1][Ring2][C][Ring1][=Branch1][N][C][Branch1][#C][C][=C][C][=C][C][=Branch1][=Branch1][=C][Ring1][=Branch1][O][C][O][C][=O][C][C][Ring2][Ring1][Branch1][C][C][=C][C][=C][C][=C][Ring1][=Branch1] Penetration: Yes SELFIE: [C][C][Branch1][C][C][Branch1][C][C][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][Branch1][Ring1][C][O][=N][Ring1][=Branch2] Penetration: No SELFIE: [C][C][Branch1][O][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][=Branch1][Ring2][=C][Ring1][#Branch1][C][Branch1][C][N][=O] Penetration: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C@@][Branch2][Branch1][=C][C@@][Branch2][Branch1][=Branch2][C@H1][Branch2][Ring2][Ring2][C@H1][C@][Branch2][Ring1][Branch1][C@@][Branch1][P][C][=Branch1][#Branch2][=C][C][=Branch1][C][=O][C][=C][Ring1][#Branch1][C][C][Ring1][O][C][Branch1][C][F][C@H1][Branch1][Ring2][C][Ring1][P][O][C][C@H1][Ring2][Ring1][Branch1][O][C][Branch1][Branch1][O][Ring2][Ring1][Branch2][Branch1][C][C][C][C][C][Branch2][Ring1][#Branch2][C][O][C][Branch2][Ring1][Ring1][C][Branch1][#C][C][N][C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][=O][C][=O][=O] Penetration: You have to predict whether it has Penetration with answer Yes or No.

Yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically penetration/non-penetration to the brain-blood barrier, based on the SELFIE string representation of each molecule. You will be provided with several example molecules, each accompanied by a binary label indicating whether it has penetrative property (Yes) or not (No). Please answer with only Yes or No. SELFIE: [C][=C][C][=Branch2][Ring1][Ring1][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][Ring2][C][O][C][O][C][Ring1][Branch2][=O][O][C][C][=C][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][C][#N] Penetration: Yes SELFIE: [C@H1][N][Branch2][Ring2][Ring2][C@H1][Branch2][Ring1][O][C][C][Branch1][Ring2][C][Ring1][=Branch1][N][C][Branch1][#C][C][=C][C][=C][C][=Branch1][=Branch1][=C][Ring1][=Branch1][O][C][O][C][=O][C][C][Ring2][Ring1][Branch1][C][C][=C][C][=C][C][=C][Ring1][=Branch1] Penetration: Yes SELFIE: [C][C][Branch1][C][C][Branch1][C][C][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][Branch1][Ring1][C][O][=N][Ring1][=Branch2] Penetration: No SELFIE: [C][C][Branch1][O][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][=Branch1][Ring2][=C][Ring1][#Branch1][C][Branch1][C][N][=O] Penetration: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [Cl][C][=C][C][=C][N][C][=Branch1][C][=O][C][C][=Branch1][C][=O][N][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring1][#C][=C][Ring2][Ring1][Ring1] Penetration: You have to predict whether it has Penetration with answer Yes or No.

Yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically penetration/non-penetration to the brain-blood barrier, based on the SELFIE string representation of each molecule. You will be provided with several example molecules, each accompanied by a binary label indicating whether it has penetrative property (Yes) or not (No). Please answer with only Yes or No. SELFIE: [C][=C][C][=Branch2][Ring1][Ring1][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][Ring2][C][O][C][O][C][Ring1][Branch2][=O][O][C][C][=C][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][C][#N] Penetration: Yes SELFIE: [C@H1][N][Branch2][Ring2][Ring2][C@H1][Branch2][Ring1][O][C][C][Branch1][Ring2][C][Ring1][=Branch1][N][C][Branch1][#C][C][=C][C][=C][C][=Branch1][=Branch1][=C][Ring1][=Branch1][O][C][O][C][=O][C][C][Ring2][Ring1][Branch1][C][C][=C][C][=C][C][=C][Ring1][=Branch1] Penetration: Yes SELFIE: [C][C][Branch1][C][C][Branch1][C][C][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][Branch1][Ring1][C][O][=N][Ring1][=Branch2] Penetration: No SELFIE: [C][C][Branch1][O][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][=Branch1][Ring2][=C][Ring1][#Branch1][C][Branch1][C][N][=O] Penetration: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][F] Penetration: You have to predict whether it has Penetration with answer Yes or No.

Yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically penetration/non-penetration to the brain-blood barrier, based on the SELFIE string representation of each molecule. You will be provided with several example molecules, each accompanied by a binary label indicating whether it has penetrative property (Yes) or not (No). Please answer with only Yes or No. SELFIE: [C][=C][C][=Branch2][Ring1][Ring1][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][Ring2][C][O][C][O][C][Ring1][Branch2][=O][O][C][C][=C][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][C][#N] Penetration: Yes SELFIE: [C@H1][N][Branch2][Ring2][Ring2][C@H1][Branch2][Ring1][O][C][C][Branch1][Ring2][C][Ring1][=Branch1][N][C][Branch1][#C][C][=C][C][=C][C][=Branch1][=Branch1][=C][Ring1][=Branch1][O][C][O][C][=O][C][C][Ring2][Ring1][Branch1][C][C][=C][C][=C][C][=C][Ring1][=Branch1] Penetration: Yes SELFIE: [C][C][Branch1][C][C][Branch1][C][C][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][Branch1][Ring1][C][O][=N][Ring1][=Branch2] Penetration: No SELFIE: [C][C][Branch1][O][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][=Branch1][Ring2][=C][Ring1][#Branch1][C][Branch1][C][N][=O] Penetration: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][C][=C][C][=C][C][=C][Ring1][=Branch1] Penetration: You have to predict whether it has Penetration with answer Yes or No.

Yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically penetration/non-penetration to the brain-blood barrier, based on the SELFIE string representation of each molecule. You will be provided with several example molecules, each accompanied by a binary label indicating whether it has penetrative property (Yes) or not (No). Please answer with only Yes or No. SELFIE: [C][=C][C][=Branch2][Ring1][Ring1][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][Ring2][C][O][C][O][C][Ring1][Branch2][=O][O][C][C][=C][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][C][#N] Penetration: Yes SELFIE: [C@H1][N][Branch2][Ring2][Ring2][C@H1][Branch2][Ring1][O][C][C][Branch1][Ring2][C][Ring1][=Branch1][N][C][Branch1][#C][C][=C][C][=C][C][=Branch1][=Branch1][=C][Ring1][=Branch1][O][C][O][C][=O][C][C][Ring2][Ring1][Branch1][C][C][=C][C][=C][C][=C][Ring1][=Branch1] Penetration: Yes SELFIE: [C][C][Branch1][C][C][Branch1][C][C][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][Branch1][Ring1][C][O][=N][Ring1][=Branch2] Penetration: No SELFIE: [C][C][Branch1][O][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][=Branch1][Ring2][=C][Ring1][#Branch1][C][Branch1][C][N][=O] Penetration: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][=C][Branch2][Ring1][N][C][=Branch1][=C][=N][N][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][C][N][C][C][O][C][C][Ring1][=Branch1][C][#N] Penetration: You have to predict whether it has Penetration with answer Yes or No.

Yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically penetration/non-penetration to the brain-blood barrier, based on the SELFIE string representation of each molecule. You will be provided with several example molecules, each accompanied by a binary label indicating whether it has penetrative property (Yes) or not (No). Please answer with only Yes or No. SELFIE: [C][=C][C][=Branch2][Ring1][Ring1][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][Ring2][C][O][C][O][C][Ring1][Branch2][=O][O][C][C][=C][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][C][#N] Penetration: Yes SELFIE: [C@H1][N][Branch2][Ring2][Ring2][C@H1][Branch2][Ring1][O][C][C][Branch1][Ring2][C][Ring1][=Branch1][N][C][Branch1][#C][C][=C][C][=C][C][=Branch1][=Branch1][=C][Ring1][=Branch1][O][C][O][C][=O][C][C][Ring2][Ring1][Branch1][C][C][=C][C][=C][C][=C][Ring1][=Branch1] Penetration: Yes SELFIE: [C][C][Branch1][C][C][Branch1][C][C][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][Branch1][Ring1][C][O][=N][Ring1][=Branch2] Penetration: No SELFIE: [C][C][Branch1][O][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][=Branch1][Ring2][=C][Ring1][#Branch1][C][Branch1][C][N][=O] Penetration: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][=C][C][=Branch2][Ring1][=N][=C][C][=C][Ring1][=Branch1][C][Branch2][Ring1][Ring1][C][C][C][N][C][C][C][C][C][Branch1][Ring2][C][Ring1][#Branch1][C][C][Ring1][#Branch1][=O][F] Penetration: You have to predict whether it has Penetration with answer Yes or No.

Yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically penetration/non-penetration to the brain-blood barrier, based on the SELFIE string representation of each molecule. You will be provided with several example molecules, each accompanied by a binary label indicating whether it has penetrative property (Yes) or not (No). Please answer with only Yes or No. SELFIE: [C][=C][C][=Branch2][Ring1][Ring1][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][Ring2][C][O][C][O][C][Ring1][Branch2][=O][O][C][C][=C][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][C][#N] Penetration: Yes SELFIE: [C@H1][N][Branch2][Ring2][Ring2][C@H1][Branch2][Ring1][O][C][C][Branch1][Ring2][C][Ring1][=Branch1][N][C][Branch1][#C][C][=C][C][=C][C][=Branch1][=Branch1][=C][Ring1][=Branch1][O][C][O][C][=O][C][C][Ring2][Ring1][Branch1][C][C][=C][C][=C][C][=C][Ring1][=Branch1] Penetration: Yes SELFIE: [C][C][Branch1][C][C][Branch1][C][C][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][Branch1][Ring1][C][O][=N][Ring1][=Branch2] Penetration: No SELFIE: [C][C][Branch1][O][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][=Branch1][Ring2][=C][Ring1][#Branch1][C][Branch1][C][N][=O] Penetration: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][=C][C][=Branch2][Ring2][Branch1][=C][C][=C][Ring1][=Branch1][N][C][C][N][Branch2][Ring1][Ring2][C][C][Branch1][C][O][C][O][C][Branch1][Branch2][C][C][C][C][C][Ring1][=Branch1][C][#C][C][C][Ring2][Ring1][Ring1][F] Penetration: You have to predict whether it has Penetration with answer Yes or No.

Yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically penetration/non-penetration to the brain-blood barrier, based on the SELFIE string representation of each molecule. You will be provided with several example molecules, each accompanied by a binary label indicating whether it has penetrative property (Yes) or not (No). Please answer with only Yes or No. SELFIE: [C][=C][C][=Branch2][Ring1][Ring1][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][Ring2][C][O][C][O][C][Ring1][Branch2][=O][O][C][C][=C][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][C][#N] Penetration: Yes SELFIE: [C@H1][N][Branch2][Ring2][Ring2][C@H1][Branch2][Ring1][O][C][C][Branch1][Ring2][C][Ring1][=Branch1][N][C][Branch1][#C][C][=C][C][=C][C][=Branch1][=Branch1][=C][Ring1][=Branch1][O][C][O][C][=O][C][C][Ring2][Ring1][Branch1][C][C][=C][C][=C][C][=C][Ring1][=Branch1] Penetration: Yes SELFIE: [C][C][Branch1][C][C][Branch1][C][C][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][Branch1][Ring1][C][O][=N][Ring1][=Branch2] Penetration: No SELFIE: [C][C][Branch1][O][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][=Branch1][Ring2][=C][Ring1][#Branch1][C][Branch1][C][N][=O] Penetration: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [N][C][Branch1][C][N][=N][C][C][C][O][C][Branch1][Branch2][C][C][C][C][C][Ring1][=Branch1][O][Ring1][#Branch2] Penetration: You have to predict whether it has Penetration with answer Yes or No.

No

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically penetration/non-penetration to the brain-blood barrier, based on the SELFIE string representation of each molecule. You will be provided with several example molecules, each accompanied by a binary label indicating whether it has penetrative property (Yes) or not (No). Please answer with only Yes or No. SELFIE: [C][=C][C][=Branch2][Ring1][Ring1][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][Ring2][C][O][C][O][C][Ring1][Branch2][=O][O][C][C][=C][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][C][#N] Penetration: Yes SELFIE: [C@H1][N][Branch2][Ring2][Ring2][C@H1][Branch2][Ring1][O][C][C][Branch1][Ring2][C][Ring1][=Branch1][N][C][Branch1][#C][C][=C][C][=C][C][=Branch1][=Branch1][=C][Ring1][=Branch1][O][C][O][C][=O][C][C][Ring2][Ring1][Branch1][C][C][=C][C][=C][C][=C][Ring1][=Branch1] Penetration: Yes SELFIE: [C][C][Branch1][C][C][Branch1][C][C][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][Branch1][Ring1][C][O][=N][Ring1][=Branch2] Penetration: No SELFIE: [C][C][Branch1][O][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][=Branch1][Ring2][=C][Ring1][#Branch1][C][Branch1][C][N][=O] Penetration: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [F][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=N][C][C][=Branch1][C][=S][N][Branch1][#Branch2][C][C][Branch1][C][F][Branch1][C][F][F][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring2][Ring1][C][Ring1][#Branch1] Penetration: You have to predict whether it has Penetration with answer Yes or No.

Yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically penetration/non-penetration to the brain-blood barrier, based on the SELFIE string representation of each molecule. You will be provided with several example molecules, each accompanied by a binary label indicating whether it has penetrative property (Yes) or not (No). Please answer with only Yes or No. SELFIE: [C][=C][C][=Branch2][Ring1][Ring1][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][Ring2][C][O][C][O][C][Ring1][Branch2][=O][O][C][C][=C][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][C][#N] Penetration: Yes SELFIE: [C@H1][N][Branch2][Ring2][Ring2][C@H1][Branch2][Ring1][O][C][C][Branch1][Ring2][C][Ring1][=Branch1][N][C][Branch1][#C][C][=C][C][=C][C][=Branch1][=Branch1][=C][Ring1][=Branch1][O][C][O][C][=O][C][C][Ring2][Ring1][Branch1][C][C][=C][C][=C][C][=C][Ring1][=Branch1] Penetration: Yes SELFIE: [C][C][Branch1][C][C][Branch1][C][C][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][Branch1][Ring1][C][O][=N][Ring1][=Branch2] Penetration: No SELFIE: [C][C][Branch1][O][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][=Branch1][Ring2][=C][Ring1][#Branch1][C][Branch1][C][N][=O] Penetration: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][C][Branch1][=N][C][Branch1][=Branch2][N][C][Branch1][Ring2][O][Ring1][Branch1][=O][=O][C] Penetration: You have to predict whether it has Penetration with answer Yes or No.

Yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically penetration/non-penetration to the brain-blood barrier, based on the SELFIE string representation of each molecule. You will be provided with several example molecules, each accompanied by a binary label indicating whether it has penetrative property (Yes) or not (No). Please answer with only Yes or No. SELFIE: [C][=C][C][=Branch2][Ring1][Ring1][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][Ring2][C][O][C][O][C][Ring1][Branch2][=O][O][C][C][=C][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][C][#N] Penetration: Yes SELFIE: [C@H1][N][Branch2][Ring2][Ring2][C@H1][Branch2][Ring1][O][C][C][Branch1][Ring2][C][Ring1][=Branch1][N][C][Branch1][#C][C][=C][C][=C][C][=Branch1][=Branch1][=C][Ring1][=Branch1][O][C][O][C][=O][C][C][Ring2][Ring1][Branch1][C][C][=C][C][=C][C][=C][Ring1][=Branch1] Penetration: Yes SELFIE: [C][C][Branch1][C][C][Branch1][C][C][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][Branch1][Ring1][C][O][=N][Ring1][=Branch2] Penetration: No SELFIE: [C][C][Branch1][O][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][=Branch1][Ring2][=C][Ring1][#Branch1][C][Branch1][C][N][=O] Penetration: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][=C][Branch2][Ring2][Branch1][C][=C][C][=C][Ring1][=Branch1][N][Branch1][#C][C][C][C][N][C][C][N][Branch1][Branch1][C][C][Ring1][=Branch1][C][C][=C][Branch1][Ring2][S][Ring1][S][C][=C][C][=C][Ring1][#Branch1][C][Branch1][C][F][Branch1][C][F][F] Penetration: You have to predict whether it has Penetration with answer Yes or No.

Yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically penetration/non-penetration to the brain-blood barrier, based on the SELFIE string representation of each molecule. You will be provided with several example molecules, each accompanied by a binary label indicating whether it has penetrative property (Yes) or not (No). Please answer with only Yes or No. SELFIE: [C][=C][C][=Branch2][Ring1][Ring1][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][Ring2][C][O][C][O][C][Ring1][Branch2][=O][O][C][C][=C][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][C][#N] Penetration: Yes SELFIE: [C@H1][N][Branch2][Ring2][Ring2][C@H1][Branch2][Ring1][O][C][C][Branch1][Ring2][C][Ring1][=Branch1][N][C][Branch1][#C][C][=C][C][=C][C][=Branch1][=Branch1][=C][Ring1][=Branch1][O][C][O][C][=O][C][C][Ring2][Ring1][Branch1][C][C][=C][C][=C][C][=C][Ring1][=Branch1] Penetration: Yes SELFIE: [C][C][Branch1][C][C][Branch1][C][C][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][Branch1][Ring1][C][O][=N][Ring1][=Branch2] Penetration: No SELFIE: [C][C][Branch1][O][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][=Branch1][Ring2][=C][Ring1][#Branch1][C][Branch1][C][N][=O] Penetration: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][C][=Branch1][C][=O][O][C][O][C][=Branch1][C][=O][C][N][C][Branch1][=Branch2][S][C][Ring1][Branch1][Branch1][C][C][C][C][Branch1][#C][N][C][=Branch1][C][=O][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring2][Ring1][C][=O] Penetration: You have to predict whether it has Penetration with answer Yes or No.

No

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically penetration/non-penetration to the brain-blood barrier, based on the SELFIE string representation of each molecule. You will be provided with several example molecules, each accompanied by a binary label indicating whether it has penetrative property (Yes) or not (No). Please answer with only Yes or No. SELFIE: [C][=C][C][=Branch2][Ring1][Ring1][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][Ring2][C][O][C][O][C][Ring1][Branch2][=O][O][C][C][=C][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][C][#N] Penetration: Yes SELFIE: [C@H1][N][Branch2][Ring2][Ring2][C@H1][Branch2][Ring1][O][C][C][Branch1][Ring2][C][Ring1][=Branch1][N][C][Branch1][#C][C][=C][C][=C][C][=Branch1][=Branch1][=C][Ring1][=Branch1][O][C][O][C][=O][C][C][Ring2][Ring1][Branch1][C][C][=C][C][=C][C][=C][Ring1][=Branch1] Penetration: Yes SELFIE: [C][C][Branch1][C][C][Branch1][C][C][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][Branch1][Ring1][C][O][=N][Ring1][=Branch2] Penetration: No SELFIE: [C][C][Branch1][O][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][=Branch1][Ring2][=C][Ring1][#Branch1][C][Branch1][C][N][=O] Penetration: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][O][C][=C][C][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][C@@H1][S][C][=C][C][=C][C][=C][Ring1][=Branch1][N][Branch1][Branch2][C][C][N][Branch1][C][C][C][C][=Branch1][C][=O][C@@H1][Ring1][P][O][C][Branch1][C][C][=O] Penetration: You have to predict whether it has Penetration with answer Yes or No.

Yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically penetration/non-penetration to the brain-blood barrier, based on the SELFIE string representation of each molecule. You will be provided with several example molecules, each accompanied by a binary label indicating whether it has penetrative property (Yes) or not (No). Please answer with only Yes or No. SELFIE: [C][=C][C][=Branch2][Ring1][Ring1][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][Ring2][C][O][C][O][C][Ring1][Branch2][=O][O][C][C][=C][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][C][#N] Penetration: Yes SELFIE: [C@H1][N][Branch2][Ring2][Ring2][C@H1][Branch2][Ring1][O][C][C][Branch1][Ring2][C][Ring1][=Branch1][N][C][Branch1][#C][C][=C][C][=C][C][=Branch1][=Branch1][=C][Ring1][=Branch1][O][C][O][C][=O][C][C][Ring2][Ring1][Branch1][C][C][=C][C][=C][C][=C][Ring1][=Branch1] Penetration: Yes SELFIE: [C][C][Branch1][C][C][Branch1][C][C][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][Branch1][Ring1][C][O][=N][Ring1][=Branch2] Penetration: No SELFIE: [C][C][Branch1][O][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][=Branch1][Ring2][=C][Ring1][#Branch1][C][Branch1][C][N][=O] Penetration: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][C][C][C][C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Ring1][=Branch2][C][=Branch1][C][=O][C][=C][C][Branch1][C][I][=C][Branch1][O][O][C][C][N][Branch1][Ring1][C][C][C][C][C][Branch1][C][I][=C][Ring1][S] Penetration: You have to predict whether it has Penetration with answer Yes or No.

No

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically penetration/non-penetration to the brain-blood barrier, based on the SELFIE string representation of each molecule. You will be provided with several example molecules, each accompanied by a binary label indicating whether it has penetrative property (Yes) or not (No). Please answer with only Yes or No. SELFIE: [C][=C][C][=Branch2][Ring1][Ring1][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][Ring2][C][O][C][O][C][Ring1][Branch2][=O][O][C][C][=C][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][C][#N] Penetration: Yes SELFIE: [C@H1][N][Branch2][Ring2][Ring2][C@H1][Branch2][Ring1][O][C][C][Branch1][Ring2][C][Ring1][=Branch1][N][C][Branch1][#C][C][=C][C][=C][C][=Branch1][=Branch1][=C][Ring1][=Branch1][O][C][O][C][=O][C][C][Ring2][Ring1][Branch1][C][C][=C][C][=C][C][=C][Ring1][=Branch1] Penetration: Yes SELFIE: [C][C][Branch1][C][C][Branch1][C][C][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][Branch1][Ring1][C][O][=N][Ring1][=Branch2] Penetration: No SELFIE: [C][C][Branch1][O][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][=Branch1][Ring2][=C][Ring1][#Branch1][C][Branch1][C][N][=O] Penetration: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [F][C][=C][C][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][C][C][C][N][C][C][C][Branch1][Branch1][C][C][Ring1][=Branch1][N][C][=Branch1][C][=O][N][C][=C][C][=C][C][=C][Ring1][#Branch2][Ring1][=Branch1] Penetration: You have to predict whether it has Penetration with answer Yes or No.

Yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically penetration/non-penetration to the brain-blood barrier, based on the SELFIE string representation of each molecule. You will be provided with several example molecules, each accompanied by a binary label indicating whether it has penetrative property (Yes) or not (No). Please answer with only Yes or No. SELFIE: [C][=C][C][=Branch2][Ring1][Ring1][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][Ring2][C][O][C][O][C][Ring1][Branch2][=O][O][C][C][=C][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][C][#N] Penetration: Yes SELFIE: [C@H1][N][Branch2][Ring2][Ring2][C@H1][Branch2][Ring1][O][C][C][Branch1][Ring2][C][Ring1][=Branch1][N][C][Branch1][#C][C][=C][C][=C][C][=Branch1][=Branch1][=C][Ring1][=Branch1][O][C][O][C][=O][C][C][Ring2][Ring1][Branch1][C][C][=C][C][=C][C][=C][Ring1][=Branch1] Penetration: Yes SELFIE: [C][C][Branch1][C][C][Branch1][C][C][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][Branch1][Ring1][C][O][=N][Ring1][=Branch2] Penetration: No SELFIE: [C][C][Branch1][O][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][=Branch1][Ring2][=C][Ring1][#Branch1][C][Branch1][C][N][=O] Penetration: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][=C][Branch1][=Branch1][C][Branch1][C][N][=O][C][=C][Branch2][Ring1][Ring2][C][=Branch1][=Branch1][=C][Ring1][=Branch2][O][C][O][C][C][C][C][C][C][C][C][C][C][O][C] Penetration: You have to predict whether it has Penetration with answer Yes or No.

Yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically penetration/non-penetration to the brain-blood barrier, based on the SELFIE string representation of each molecule. You will be provided with several example molecules, each accompanied by a binary label indicating whether it has penetrative property (Yes) or not (No). Please answer with only Yes or No. SELFIE: [C][=C][C][=Branch2][Ring1][Ring1][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][Ring2][C][O][C][O][C][Ring1][Branch2][=O][O][C][C][=C][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][C][#N] Penetration: Yes SELFIE: [C@H1][N][Branch2][Ring2][Ring2][C@H1][Branch2][Ring1][O][C][C][Branch1][Ring2][C][Ring1][=Branch1][N][C][Branch1][#C][C][=C][C][=C][C][=Branch1][=Branch1][=C][Ring1][=Branch1][O][C][O][C][=O][C][C][Ring2][Ring1][Branch1][C][C][=C][C][=C][C][=C][Ring1][=Branch1] Penetration: Yes SELFIE: [C][C][Branch1][C][C][Branch1][C][C][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][Branch1][Ring1][C][O][=N][Ring1][=Branch2] Penetration: No SELFIE: [C][C][Branch1][O][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][=Branch1][Ring2][=C][Ring1][#Branch1][C][Branch1][C][N][=O] Penetration: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][=C][Branch2][Ring1][=Branch1][C][=C][Branch1][P][C][=C][Ring1][=Branch1][O][C][C][C][N][C][Branch1][Ring2][O][Ring1][Branch1][=O][C][C] Penetration: You have to predict whether it has Penetration with answer Yes or No.

Yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically penetration/non-penetration to the brain-blood barrier, based on the SELFIE string representation of each molecule. You will be provided with several example molecules, each accompanied by a binary label indicating whether it has penetrative property (Yes) or not (No). Please answer with only Yes or No. SELFIE: [C][=C][C][=Branch2][Ring1][Ring1][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][Ring2][C][O][C][O][C][Ring1][Branch2][=O][O][C][C][=C][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][C][#N] Penetration: Yes SELFIE: [C@H1][N][Branch2][Ring2][Ring2][C@H1][Branch2][Ring1][O][C][C][Branch1][Ring2][C][Ring1][=Branch1][N][C][Branch1][#C][C][=C][C][=C][C][=Branch1][=Branch1][=C][Ring1][=Branch1][O][C][O][C][=O][C][C][Ring2][Ring1][Branch1][C][C][=C][C][=C][C][=C][Ring1][=Branch1] Penetration: Yes SELFIE: [C][C][Branch1][C][C][Branch1][C][C][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][Branch1][Ring1][C][O][=N][Ring1][=Branch2] Penetration: No SELFIE: [C][C][Branch1][O][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][=Branch1][Ring2][=C][Ring1][#Branch1][C][Branch1][C][N][=O] Penetration: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][=C][Branch2][Ring2][Ring2][C][Branch2][Ring1][Branch2][N][C][C][N][Branch1][=C][\N][=C][\C][=N][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][C][C][C][Ring1][#C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][Ring2][Ring1][N] Penetration: You have to predict whether it has Penetration with answer Yes or No.

Yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically penetration/non-penetration to the brain-blood barrier, based on the SELFIE string representation of each molecule. You will be provided with several example molecules, each accompanied by a binary label indicating whether it has penetrative property (Yes) or not (No). Please answer with only Yes or No. SELFIE: [C][=C][C][=Branch2][Ring1][Ring1][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][Ring2][C][O][C][O][C][Ring1][Branch2][=O][O][C][C][=C][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][C][#N] Penetration: Yes SELFIE: [C@H1][N][Branch2][Ring2][Ring2][C@H1][Branch2][Ring1][O][C][C][Branch1][Ring2][C][Ring1][=Branch1][N][C][Branch1][#C][C][=C][C][=C][C][=Branch1][=Branch1][=C][Ring1][=Branch1][O][C][O][C][=O][C][C][Ring2][Ring1][Branch1][C][C][=C][C][=C][C][=C][Ring1][=Branch1] Penetration: Yes SELFIE: [C][C][Branch1][C][C][Branch1][C][C][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][Branch1][Ring1][C][O][=N][Ring1][=Branch2] Penetration: No SELFIE: [C][C][Branch1][O][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][=Branch1][Ring2][=C][Ring1][#Branch1][C][Branch1][C][N][=O] Penetration: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][C][Branch1][C][C][C][O][N][=C][Branch1][Ring2][N][=Ring1][Branch1][C][N][=C][N][C][=Ring1][Branch1][C][N][Branch1][C][C][C][=Branch1][C][=O][C][=C][Branch1][C][Cl][C][=C][C][=C][Ring1][=C][Ring1][#Branch1] Penetration: You have to predict whether it has Penetration with answer Yes or No.

Yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically penetration/non-penetration to the brain-blood barrier, based on the SELFIE string representation of each molecule. You will be provided with several example molecules, each accompanied by a binary label indicating whether it has penetrative property (Yes) or not (No). Please answer with only Yes or No. SELFIE: [C][=C][C][=Branch2][Ring1][Ring1][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][Ring2][C][O][C][O][C][Ring1][Branch2][=O][O][C][C][=C][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][C][#N] Penetration: Yes SELFIE: [C@H1][N][Branch2][Ring2][Ring2][C@H1][Branch2][Ring1][O][C][C][Branch1][Ring2][C][Ring1][=Branch1][N][C][Branch1][#C][C][=C][C][=C][C][=Branch1][=Branch1][=C][Ring1][=Branch1][O][C][O][C][=O][C][C][Ring2][Ring1][Branch1][C][C][=C][C][=C][C][=C][Ring1][=Branch1] Penetration: Yes SELFIE: [C][C][Branch1][C][C][Branch1][C][C][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][Branch1][Ring1][C][O][=N][Ring1][=Branch2] Penetration: No SELFIE: [C][C][Branch1][O][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][=Branch1][Ring2][=C][Ring1][#Branch1][C][Branch1][C][N][=O] Penetration: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][=C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][C][=C][C][=C][Ring1][#Branch2][C][=C][C][N][Branch1][Branch1][C][C][Ring1][=Branch1][C][C][C][=C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][Ring1][#Branch2] Penetration: You have to predict whether it has Penetration with answer Yes or No.

Yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically penetration/non-penetration to the brain-blood barrier, based on the SELFIE string representation of each molecule. You will be provided with several example molecules, each accompanied by a binary label indicating whether it has penetrative property (Yes) or not (No). Please answer with only Yes or No. SELFIE: [C][=C][C][=Branch2][Ring1][Ring1][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][Ring2][C][O][C][O][C][Ring1][Branch2][=O][O][C][C][=C][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][C][#N] Penetration: Yes SELFIE: [C@H1][N][Branch2][Ring2][Ring2][C@H1][Branch2][Ring1][O][C][C][Branch1][Ring2][C][Ring1][=Branch1][N][C][Branch1][#C][C][=C][C][=C][C][=Branch1][=Branch1][=C][Ring1][=Branch1][O][C][O][C][=O][C][C][Ring2][Ring1][Branch1][C][C][=C][C][=C][C][=C][Ring1][=Branch1] Penetration: Yes SELFIE: [C][C][Branch1][C][C][Branch1][C][C][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][Branch1][Ring1][C][O][=N][Ring1][=Branch2] Penetration: No SELFIE: [C][C][Branch1][O][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][=Branch1][Ring2][=C][Ring1][#Branch1][C][Branch1][C][N][=O] Penetration: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][=C][Branch1][C][C][C][=C][C][=C][Ring1][#Branch1][C][=Branch1][#C][=N][C][=C][Branch1][#Branch1][C][=C][C][=C][Ring1][=Branch1][S][Ring1][O][N][C][C][N][Branch1][C][C][C][C][Ring1][#Branch1] Penetration: You have to predict whether it has Penetration with answer Yes or No.

Yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically penetration/non-penetration to the brain-blood barrier, based on the SELFIE string representation of each molecule. You will be provided with several example molecules, each accompanied by a binary label indicating whether it has penetrative property (Yes) or not (No). Please answer with only Yes or No. SELFIE: [C][=C][C][=Branch2][Ring1][Ring1][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][Ring2][C][O][C][O][C][Ring1][Branch2][=O][O][C][C][=C][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][C][#N] Penetration: Yes SELFIE: [C@H1][N][Branch2][Ring2][Ring2][C@H1][Branch2][Ring1][O][C][C][Branch1][Ring2][C][Ring1][=Branch1][N][C][Branch1][#C][C][=C][C][=C][C][=Branch1][=Branch1][=C][Ring1][=Branch1][O][C][O][C][=O][C][C][Ring2][Ring1][Branch1][C][C][=C][C][=C][C][=C][Ring1][=Branch1] Penetration: Yes SELFIE: [C][C][Branch1][C][C][Branch1][C][C][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][Branch1][Ring1][C][O][=N][Ring1][=Branch2] Penetration: No SELFIE: [C][C][Branch1][O][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][=Branch1][Ring2][=C][Ring1][#Branch1][C][Branch1][C][N][=O] Penetration: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][=C][Branch1][=Branch1][C][Branch1][C][C][=O][C][=C][C][=Branch2][Ring1][Branch1][=C][Ring1][=Branch2][C][Branch1][=C][N][C][C][N][Branch1][=Branch1][C][C][C][Ring1][Branch1][C][C][=O][O][C] Penetration: You have to predict whether it has Penetration with answer Yes or No.

Yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically penetration/non-penetration to the brain-blood barrier, based on the SELFIE string representation of each molecule. You will be provided with several example molecules, each accompanied by a binary label indicating whether it has penetrative property (Yes) or not (No). Please answer with only Yes or No. SELFIE: [C][=C][C][=Branch2][Ring1][Ring1][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][Ring2][C][O][C][O][C][Ring1][Branch2][=O][O][C][C][=C][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][C][#N] Penetration: Yes SELFIE: [C@H1][N][Branch2][Ring2][Ring2][C@H1][Branch2][Ring1][O][C][C][Branch1][Ring2][C][Ring1][=Branch1][N][C][Branch1][#C][C][=C][C][=C][C][=Branch1][=Branch1][=C][Ring1][=Branch1][O][C][O][C][=O][C][C][Ring2][Ring1][Branch1][C][C][=C][C][=C][C][=C][Ring1][=Branch1] Penetration: Yes SELFIE: [C][C][Branch1][C][C][Branch1][C][C][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][Branch1][Ring1][C][O][=N][Ring1][=Branch2] Penetration: No SELFIE: [C][C][Branch1][O][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][=Branch1][Ring2][=C][Ring1][#Branch1][C][Branch1][C][N][=O] Penetration: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][N][Branch1][C][C][C][C][=C][C][=C][Branch2][Ring1][#C][C][S][C][C][N][C][=C][Branch1][=Branch1][N+1][Branch1][C][O-1][=O][C][Branch1][#Branch2][C][C][=C][C][=C][C][=C][Ring1][=Branch1][=C][N][Ring1][#C][O][Ring2][Ring1][=Branch2] Penetration: You have to predict whether it has Penetration with answer Yes or No.

Yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically penetration/non-penetration to the brain-blood barrier, based on the SELFIE string representation of each molecule. You will be provided with several example molecules, each accompanied by a binary label indicating whether it has penetrative property (Yes) or not (No). Please answer with only Yes or No. SELFIE: [C][=C][C][=Branch2][Ring1][Ring1][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][Ring2][C][O][C][O][C][Ring1][Branch2][=O][O][C][C][=C][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][C][#N] Penetration: Yes SELFIE: [C@H1][N][Branch2][Ring2][Ring2][C@H1][Branch2][Ring1][O][C][C][Branch1][Ring2][C][Ring1][=Branch1][N][C][Branch1][#C][C][=C][C][=C][C][=Branch1][=Branch1][=C][Ring1][=Branch1][O][C][O][C][=O][C][C][Ring2][Ring1][Branch1][C][C][=C][C][=C][C][=C][Ring1][=Branch1] Penetration: Yes SELFIE: [C][C][Branch1][C][C][Branch1][C][C][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][Branch1][Ring1][C][O][=N][Ring1][=Branch2] Penetration: No SELFIE: [C][C][Branch1][O][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][=Branch1][Ring2][=C][Ring1][#Branch1][C][Branch1][C][N][=O] Penetration: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C@@H1][C@H1][Branch2][Ring1][=Branch2][C@H1][C@][Branch1][=N][C@@H1][Branch1][=Branch1][C][Branch1][C][C][=O][C][C][Ring1][Branch2][Branch1][C][C][C][C@@H1][Ring1][=N][O][C][C@H1][Branch1][C][C][C][=C][C][=Branch1][C][=O][C][C][C@][Ring2][Ring1][Branch2][Ring1][#Branch1][C] Penetration: You have to predict whether it has Penetration with answer Yes or No.

Yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically penetration/non-penetration to the brain-blood barrier, based on the SELFIE string representation of each molecule. You will be provided with several example molecules, each accompanied by a binary label indicating whether it has penetrative property (Yes) or not (No). Please answer with only Yes or No. SELFIE: [C][=C][C][=Branch2][Ring1][Ring1][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][Ring2][C][O][C][O][C][Ring1][Branch2][=O][O][C][C][=C][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][C][#N] Penetration: Yes SELFIE: [C@H1][N][Branch2][Ring2][Ring2][C@H1][Branch2][Ring1][O][C][C][Branch1][Ring2][C][Ring1][=Branch1][N][C][Branch1][#C][C][=C][C][=C][C][=Branch1][=Branch1][=C][Ring1][=Branch1][O][C][O][C][=O][C][C][Ring2][Ring1][Branch1][C][C][=C][C][=C][C][=C][Ring1][=Branch1] Penetration: Yes SELFIE: [C][C][Branch1][C][C][Branch1][C][C][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][Branch1][Ring1][C][O][=N][Ring1][=Branch2] Penetration: No SELFIE: [C][C][Branch1][O][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][=Branch1][Ring2][=C][Ring1][#Branch1][C][Branch1][C][N][=O] Penetration: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][Branch1][O][C][Branch1][#Branch1][C][N][Branch1][C][C][C][O][C][=C][C][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][Cl] Penetration: You have to predict whether it has Penetration with answer Yes or No.

Yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically penetration/non-penetration to the brain-blood barrier, based on the SELFIE string representation of each molecule. You will be provided with several example molecules, each accompanied by a binary label indicating whether it has penetrative property (Yes) or not (No). Please answer with only Yes or No. SELFIE: [C][=C][C][=Branch2][Ring1][Ring1][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][Ring2][C][O][C][O][C][Ring1][Branch2][=O][O][C][C][=C][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][C][#N] Penetration: Yes SELFIE: [C@H1][N][Branch2][Ring2][Ring2][C@H1][Branch2][Ring1][O][C][C][Branch1][Ring2][C][Ring1][=Branch1][N][C][Branch1][#C][C][=C][C][=C][C][=Branch1][=Branch1][=C][Ring1][=Branch1][O][C][O][C][=O][C][C][Ring2][Ring1][Branch1][C][C][=C][C][=C][C][=C][Ring1][=Branch1] Penetration: Yes SELFIE: [C][C][Branch1][C][C][Branch1][C][C][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][Branch1][Ring1][C][O][=N][Ring1][=Branch2] Penetration: No SELFIE: [C][C][Branch1][O][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][=Branch1][Ring2][=C][Ring1][#Branch1][C][Branch1][C][N][=O] Penetration: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][C][O][C][=Branch1][C][=O][C][N][=C][N][C][=Ring1][Branch1][C][N][Branch1][C][C][C][=Branch1][C][=O][C][=C][C][Branch1][C][F][=C][C][=C][Ring1][=C][Ring1][#Branch1] Penetration: You have to predict whether it has Penetration with answer Yes or No.

Yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically penetration/non-penetration to the brain-blood barrier, based on the SELFIE string representation of each molecule. You will be provided with several example molecules, each accompanied by a binary label indicating whether it has penetrative property (Yes) or not (No). Please answer with only Yes or No. SELFIE: [C][=C][C][=Branch2][Ring1][Ring1][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][Ring2][C][O][C][O][C][Ring1][Branch2][=O][O][C][C][=C][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][C][#N] Penetration: Yes SELFIE: [C@H1][N][Branch2][Ring2][Ring2][C@H1][Branch2][Ring1][O][C][C][Branch1][Ring2][C][Ring1][=Branch1][N][C][Branch1][#C][C][=C][C][=C][C][=Branch1][=Branch1][=C][Ring1][=Branch1][O][C][O][C][=O][C][C][Ring2][Ring1][Branch1][C][C][=C][C][=C][C][=C][Ring1][=Branch1] Penetration: Yes SELFIE: [C][C][Branch1][C][C][Branch1][C][C][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][Branch1][Ring1][C][O][=N][Ring1][=Branch2] Penetration: No SELFIE: [C][C][Branch1][O][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][=Branch1][Ring2][=C][Ring1][#Branch1][C][Branch1][C][N][=O] Penetration: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][C][C][=Branch1][C][=O][N][Branch2][Ring1][Branch1][C][C][C][N][Branch1][Branch1][C][C][Ring1][=Branch1][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1] Penetration: You have to predict whether it has Penetration with answer Yes or No.

Yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically penetration/non-penetration to the brain-blood barrier, based on the SELFIE string representation of each molecule. You will be provided with several example molecules, each accompanied by a binary label indicating whether it has penetrative property (Yes) or not (No). Please answer with only Yes or No. SELFIE: [C][=C][C][=Branch2][Ring1][Ring1][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][Ring2][C][O][C][O][C][Ring1][Branch2][=O][O][C][C][=C][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][C][#N] Penetration: Yes SELFIE: [C@H1][N][Branch2][Ring2][Ring2][C@H1][Branch2][Ring1][O][C][C][Branch1][Ring2][C][Ring1][=Branch1][N][C][Branch1][#C][C][=C][C][=C][C][=Branch1][=Branch1][=C][Ring1][=Branch1][O][C][O][C][=O][C][C][Ring2][Ring1][Branch1][C][C][=C][C][=C][C][=C][Ring1][=Branch1] Penetration: Yes SELFIE: [C][C][Branch1][C][C][Branch1][C][C][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][Branch1][Ring1][C][O][=N][Ring1][=Branch2] Penetration: No SELFIE: [C][C][Branch1][O][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][=Branch1][Ring2][=C][Ring1][#Branch1][C][Branch1][C][N][=O] Penetration: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][O][C][=C][C][=C][Branch2][Ring2][=N][C][C@H1][Branch1][C][N][C][=Branch1][C][=O][N][C][C@@H1][Branch1][C][O][C@@H1][Branch1][#Branch1][O][C@@H1][Ring1][=Branch1][C][O][N][C][=N][C][=C][Branch1][=Branch2][N][=C][N][=C][Ring1][=Branch2][Ring1][=Branch1][N][Branch1][C][C][C][C][=C][Ring2][Ring1][S] Penetration: You have to predict whether it has Penetration with answer Yes or No.

No

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically penetration/non-penetration to the brain-blood barrier, based on the SELFIE string representation of each molecule. You will be provided with several example molecules, each accompanied by a binary label indicating whether it has penetrative property (Yes) or not (No). Please answer with only Yes or No. SELFIE: [C][=C][C][=Branch2][Ring1][Ring1][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][Ring2][C][O][C][O][C][Ring1][Branch2][=O][O][C][C][=C][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][C][#N] Penetration: Yes SELFIE: [C@H1][N][Branch2][Ring2][Ring2][C@H1][Branch2][Ring1][O][C][C][Branch1][Ring2][C][Ring1][=Branch1][N][C][Branch1][#C][C][=C][C][=C][C][=Branch1][=Branch1][=C][Ring1][=Branch1][O][C][O][C][=O][C][C][Ring2][Ring1][Branch1][C][C][=C][C][=C][C][=C][Ring1][=Branch1] Penetration: Yes SELFIE: [C][C][Branch1][C][C][Branch1][C][C][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][Branch1][Ring1][C][O][=N][Ring1][=Branch2] Penetration: No SELFIE: [C][C][Branch1][O][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][=Branch1][Ring2][=C][Ring1][#Branch1][C][Branch1][C][N][=O] Penetration: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][N][Branch1][C][C][C][C][C][N][C][=C][C][=C][C][=C][Ring1][=Branch1][S][C][=C][C][=C][C][=C][Ring1][=C][Ring1][=Branch1] Penetration: You have to predict whether it has Penetration with answer Yes or No.

Yes

You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge. Please strictly follow the format, no other information can be provided. Given the SELFIE string of a molecule, the task focuses on predicting molecular properties, specifically penetration/non-penetration to the brain-blood barrier, based on the SELFIE string representation of each molecule. You will be provided with several example molecules, each accompanied by a binary label indicating whether it has penetrative property (Yes) or not (No). Please answer with only Yes or No. SELFIE: [C][=C][C][=Branch2][Ring1][Ring1][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][Ring2][C][O][C][O][C][Ring1][Branch2][=O][O][C][C][=C][C][=Branch1][=Branch1][=C][C][=C][Ring1][=Branch1][C][#N] Penetration: Yes SELFIE: [C@H1][N][Branch2][Ring2][Ring2][C@H1][Branch2][Ring1][O][C][C][Branch1][Ring2][C][Ring1][=Branch1][N][C][Branch1][#C][C][=C][C][=C][C][=Branch1][=Branch1][=C][Ring1][=Branch1][O][C][O][C][=O][C][C][Ring2][Ring1][Branch1][C][C][=C][C][=C][C][=C][Ring1][=Branch1] Penetration: Yes SELFIE: [C][C][Branch1][C][C][Branch1][C][C][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][Branch1][Ring1][C][O][=N][Ring1][=Branch2] Penetration: No SELFIE: [C][C][Branch1][O][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][C][O][C][=C][C][=C][Branch1][C][O][C][=Branch1][Ring2][=C][Ring1][#Branch1][C][Branch1][C][N][=O] Penetration: No Below is the molecule whose property you have to predict. Along with is the image structure of the molecule. SELFIE: [C][C][C][Branch1][Ring1][C][C][C][=Branch1][C][=O][N][C][C][Branch1][C][C][C][Ring1][#Branch2][=O] Penetration: You have to predict whether it has Penetration with answer Yes or No.

Yes