text stringlengths 609 1.38k | messages stringclasses 0
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|---|---|---|---|---|
<|im_start|>system
You are a medicinal chemist optimizing drug molecules. Use the modify_molecule tool to make minimal structural changes that improve the specified ADMET properties while preserving the scaffold.<|im_end|>
<|im_start|>user
Molecule: [N][C][=N][C][=Branch1][C][=O][N][Branch1][N][C@H1][C][=C][C@@H1][Bran... | null | null | null | null |
<|im_start|>system
You are a medicinal chemist optimizing drug molecules. Use the modify_molecule tool to make minimal structural changes that improve the specified ADMET properties while preserving the scaffold.<|im_end|>
<|im_start|>user
Molecule: [C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][C][N][Branch2][Ring... | null | null | null | null |
<|im_start|>system
You are a medicinal chemist optimizing drug molecules. Use the modify_molecule tool to make minimal structural changes that improve the specified ADMET properties while preserving the scaffold.<|im_end|>
<|im_start|>user
Molecule: [N][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][Branch1][=Branc... | null | null | null | null |
<|im_start|>system
You are a medicinal chemist optimizing drug molecules. Use the modify_molecule tool to make minimal structural changes that improve the specified ADMET properties while preserving the scaffold.<|im_end|>
<|im_start|>user
Molecule: [N][C][=Branch1][C][=O][C][=C][C][=C][N][=C][Ring1][=Branch1]
Target: ... | null | null | null | null |
<|im_start|>system
You are a medicinal chemist optimizing drug molecules. Use the modify_molecule tool to make minimal structural changes that improve the specified ADMET properties while preserving the scaffold.<|im_end|>
<|im_start|>user
Molecule: [C][C][C@][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][O]... | null | null | null | null |
<|im_start|>system
You are a medicinal chemist optimizing drug molecules. Use the modify_molecule tool to make minimal structural changes that improve the specified ADMET properties while preserving the scaffold.<|im_end|>
<|im_start|>user
Molecule: [C][C][=C][C][=C][C][Branch2][Ring1][=Branch1][N][C][=C][C][Branch1][C... | null | null | null | null |
<|im_start|>system
You are a medicinal chemist optimizing drug molecules. Use the modify_molecule tool to make minimal structural changes that improve the specified ADMET properties while preserving the scaffold.<|im_end|>
<|im_start|>user
Molecule: [N][C][S][C][=C][Branch2][Ring1][Ring1][C][=Ring1][Branch1][C][=Branch... | null | null | null | null |
<|im_start|>system
You are a medicinal chemist optimizing drug molecules. Use the modify_molecule tool to make minimal structural changes that improve the specified ADMET properties while preserving the scaffold.<|im_end|>
<|im_start|>user
Molecule: [C][C][C@][C][C][C][N][C][C][C][=C][Branch2][Ring1][P][N][Branch1][=C]... | null | null | null | null |
<|im_start|>system
You are a medicinal chemist optimizing drug molecules. Use the modify_molecule tool to make minimal structural changes that improve the specified ADMET properties while preserving the scaffold.<|im_end|>
<|im_start|>user
Molecule: [C][C][C][C][S][=Branch1][C][=O][=Branch1][C][=O][N][C@@H1][Branch2][R... | null | null | null | null |
<|im_start|>system
You are a medicinal chemist optimizing drug molecules. Use the modify_molecule tool to make minimal structural changes that improve the specified ADMET properties while preserving the scaffold.<|im_end|>
<|im_start|>user
Molecule: [C][S+1][Branch1][C][O-1][C][=C][C][=C][O][C][=C][C][=C][Branch1][=Bra... | null | null | null | null |
<|im_start|>system
You are a medicinal chemist optimizing drug molecules. Use the modify_molecule tool to make minimal structural changes that improve the specified ADMET properties while preserving the scaffold.<|im_end|>
<|im_start|>user
Molecule: [O][=C][Branch1][=Branch2][O][C][C][Branch1][C][O][C][O][C][=C][C][=C]... | null | null | null | null |
<|im_start|>system
You are a medicinal chemist optimizing drug molecules. Use the modify_molecule tool to make minimal structural changes that improve the specified ADMET properties while preserving the scaffold.<|im_end|>
<|im_start|>user
Molecule: [C][C][C@@H1][Branch2][Ring2][Branch1][N][C][=C][Branch2][Ring1][=Bran... | null | null | null | null |
<|im_start|>system
You are a medicinal chemist optimizing drug molecules. Use the modify_molecule tool to make minimal structural changes that improve the specified ADMET properties while preserving the scaffold.<|im_end|>
<|im_start|>user
Molecule: [O][=C][Branch2][Ring1][Ring1][N][C][=C][C][=C][Branch1][Branch2][C][=... | null | null | null | null |
<|im_start|>system
You are a medicinal chemist optimizing drug molecules. Use the modify_molecule tool to make minimal structural changes that improve the specified ADMET properties while preserving the scaffold.<|im_end|>
<|im_start|>user
Molecule: [C][O][C][=Branch1][C][=O][C][=C][Branch1][C][C][N][C][Branch1][C][C][... | null | null | null | null |
<|im_start|>system
You are a medicinal chemist optimizing drug molecules. Use the modify_molecule tool to make minimal structural changes that improve the specified ADMET properties while preserving the scaffold.<|im_end|>
<|im_start|>user
Molecule: [O][C][C][Branch1][C][O][C][N][C][C][N][Branch1][=Branch2][C][=C][C][=... | null | null | null | null |
<|im_start|>system
You are a medicinal chemist optimizing drug molecules. Use the modify_molecule tool to make minimal structural changes that improve the specified ADMET properties while preserving the scaffold.<|im_end|>
<|im_start|>user
Molecule: [C][C][=C][Branch1][C][C][C][=Branch1][C][=O][C][Branch1][=C][C][C][C]... | null | null | null | null |
<|im_start|>system
You are a medicinal chemist optimizing drug molecules. Use the modify_molecule tool to make minimal structural changes that improve the specified ADMET properties while preserving the scaffold.<|im_end|>
<|im_start|>user
Molecule: [C][N][N][C][C][=C][C][=C][Branch1][O][C][=Branch1][C][=O][N][C][Branc... | null | null | null | null |
<|im_start|>system
You are a medicinal chemist optimizing drug molecules. Use the modify_molecule tool to make minimal structural changes that improve the specified ADMET properties while preserving the scaffold.<|im_end|>
<|im_start|>user
Molecule: [O][=C][N][C][=Branch1][C][=O][C][Branch2][Ring1][=C][C][C][=C][C][=C]... | null | null | null | null |
<|im_start|>system
You are a medicinal chemist optimizing drug molecules. Use the modify_molecule tool to make minimal structural changes that improve the specified ADMET properties while preserving the scaffold.<|im_end|>
<|im_start|>user
Molecule: [C][N][C][Branch1][=N][C][=Branch1][C][=O][N][C][=N][C][=C][S][Ring1][... | null | null | null | null |
<|im_start|>system
You are a medicinal chemist optimizing drug molecules. Use the modify_molecule tool to make minimal structural changes that improve the specified ADMET properties while preserving the scaffold.<|im_end|>
<|im_start|>user
Molecule: [C][N][C][C][N][C][=C][C][=C][C][C][=Branch1][O][=N][N][Ring1][Branch1... | null | null | null | null |
<|im_start|>system
You are a medicinal chemist optimizing drug molecules. Use the modify_molecule tool to make minimal structural changes that improve the specified ADMET properties while preserving the scaffold.<|im_end|>
<|im_start|>user
Molecule: [C][C][=C][C][=C][Branch1][C][Cl][C][Branch1][P][O][C][C][Branch1][C][... | null | null | null | null |
<|im_start|>system
You are a medicinal chemist optimizing drug molecules. Use the modify_molecule tool to make minimal structural changes that improve the specified ADMET properties while preserving the scaffold.<|im_end|>
<|im_start|>user
Molecule: [C][O][C][=C][C][=C][C][Branch1][Ring1][O][C][=C][Ring1][Branch2][C][=... | null | null | null | null |
<|im_start|>system
You are a medicinal chemist optimizing drug molecules. Use the modify_molecule tool to make minimal structural changes that improve the specified ADMET properties while preserving the scaffold.<|im_end|>
<|im_start|>user
Molecule: [N][C][C][C][S][=Branch1][C][=O][=Branch1][C][=O][O]
Target: Bioavaila... | null | null | null | null |
<|im_start|>system
You are a medicinal chemist optimizing drug molecules. Use the modify_molecule tool to make minimal structural changes that improve the specified ADMET properties while preserving the scaffold.<|im_end|>
<|im_start|>user
Molecule: [C][O][C][=C][C][=C][C][=C][N+1][=Branch1][#Branch2][=C][C][Ring1][=Br... | null | null | null | null |
<|im_start|>system
You are a medicinal chemist optimizing drug molecules. Use the modify_molecule tool to make minimal structural changes that improve the specified ADMET properties while preserving the scaffold.<|im_end|>
<|im_start|>user
Molecule: [C][C][C][=Branch1][C][=O][N][Branch1][#C][C][=C][C][=C][Branch1][C][C... | null | null | null | null |
<|im_start|>system
You are a medicinal chemist optimizing drug molecules. Use the modify_molecule tool to make minimal structural changes that improve the specified ADMET properties while preserving the scaffold.<|im_end|>
<|im_start|>user
Molecule: [C][N][C][=Branch1][C][=O][C][O][C][=C][C][=C][C][=C][Ring1][=Branch1]... | null | null | null | null |
<|im_start|>system
You are a medicinal chemist optimizing drug molecules. Use the modify_molecule tool to make minimal structural changes that improve the specified ADMET properties while preserving the scaffold.<|im_end|>
<|im_start|>user
Molecule: [O][=C][C][C@@][Branch1][Branch2][C][=Branch1][C][=O][N][Ring1][=Branc... | null | null | null | null |
<|im_start|>system
You are a medicinal chemist optimizing drug molecules. Use the modify_molecule tool to make minimal structural changes that improve the specified ADMET properties while preserving the scaffold.<|im_end|>
<|im_start|>user
Molecule: [C][C][=N][C][=C][N][Ring1][Branch1][C][=C][C][=C][Branch1][C][Cl][C][... | null | null | null | null |
<|im_start|>system
You are a medicinal chemist optimizing drug molecules. Use the modify_molecule tool to make minimal structural changes that improve the specified ADMET properties while preserving the scaffold.<|im_end|>
<|im_start|>user
Molecule: [C][C][Branch1][=N][C][C][=C][C][=C][Branch1][C][O][C][=C][Ring1][#Bra... | null | null | null | null |
<|im_start|>system
You are a medicinal chemist optimizing drug molecules. Use the modify_molecule tool to make minimal structural changes that improve the specified ADMET properties while preserving the scaffold.<|im_end|>
<|im_start|>user
Molecule: [C][C][C@@H1][Branch1][C][O][C][Branch1][O][C][C@@H1][Branch1][C][C][N... | null | null | null | null |
<|im_start|>system
You are a medicinal chemist optimizing drug molecules. Use the modify_molecule tool to make minimal structural changes that improve the specified ADMET properties while preserving the scaffold.<|im_end|>
<|im_start|>user
Molecule: [C][N][Branch1][C][C][C][=Branch1][C][=O][C][O][C][=Branch1][C][=O][C]... | null | null | null | null |
<|im_start|>system
You are a medicinal chemist optimizing drug molecules. Use the modify_molecule tool to make minimal structural changes that improve the specified ADMET properties while preserving the scaffold.<|im_end|>
<|im_start|>user
Molecule: [C][C][N+1][Branch1][C][C][Branch1][C][C][C][=C][C][=C][C][Branch1][C]... | null | null | null | null |
<|im_start|>system
You are a medicinal chemist optimizing drug molecules. Use the modify_molecule tool to make minimal structural changes that improve the specified ADMET properties while preserving the scaffold.<|im_end|>
<|im_start|>user
Molecule: [N][C][=N][C][=C][C][=C][Branch1][#Branch2][O][C][Branch1][C][F][Branc... | null | null | null | null |
<|im_start|>system
You are a medicinal chemist optimizing drug molecules. Use the modify_molecule tool to make minimal structural changes that improve the specified ADMET properties while preserving the scaffold.<|im_end|>
<|im_start|>user
Molecule: [C][O][C][=C][C][=C][C][Branch2][Ring2][Ring1][C][=C][C][=C][Branch2][... | null | null | null | null |
<|im_start|>system
You are a medicinal chemist optimizing drug molecules. Use the modify_molecule tool to make minimal structural changes that improve the specified ADMET properties while preserving the scaffold.<|im_end|>
<|im_start|>user
Molecule: [C][C][=Branch1][C][=O][C][=C][C][=C][NH1][C][=C][Branch1][Ring2][C][C... | null | null | null | null |
<|im_start|>system
You are a medicinal chemist optimizing drug molecules. Use the modify_molecule tool to make minimal structural changes that improve the specified ADMET properties while preserving the scaffold.<|im_end|>
<|im_start|>user
Molecule: [O][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C@@][C][C][... | null | null | null | null |
<|im_start|>system
You are a medicinal chemist optimizing drug molecules. Use the modify_molecule tool to make minimal structural changes that improve the specified ADMET properties while preserving the scaffold.<|im_end|>
<|im_start|>user
Molecule: [N][C][C][N][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][Cl][C][=N][... | null | null | null | null |
<|im_start|>system
You are a medicinal chemist optimizing drug molecules. Use the modify_molecule tool to make minimal structural changes that improve the specified ADMET properties while preserving the scaffold.<|im_end|>
<|im_start|>user
Molecule: [C][C][Branch1][C][C][C][Branch2][Ring1][=N][N][C][=Branch1][C][=O][C]... | null | null | null | null |
<|im_start|>system
You are a medicinal chemist optimizing drug molecules. Use the modify_molecule tool to make minimal structural changes that improve the specified ADMET properties while preserving the scaffold.<|im_end|>
<|im_start|>user
Molecule: [C][C][N][Branch1][Ring1][C][C][S][=Branch1][C][=O][=Branch1][C][=O][N... | null | null | null | null |
<|im_start|>system
You are a medicinal chemist optimizing drug molecules. Use the modify_molecule tool to make minimal structural changes that improve the specified ADMET properties while preserving the scaffold.<|im_end|>
<|im_start|>user
Molecule: [O][=C][Branch1][C][O][C@@H1][C][S][C@H1][Branch1][#Branch2][C][=C][C]... | null | null | null | null |
<|im_start|>system
You are a medicinal chemist optimizing drug molecules. Use the modify_molecule tool to make minimal structural changes that improve the specified ADMET properties while preserving the scaffold.<|im_end|>
<|im_start|>user
Molecule: [C][/C][=C][Branch1][=Branch2][\C][=C][C][=C][C][=C][Ring1][=Branch1][... | null | null | null | null |
<|im_start|>system
You are a medicinal chemist optimizing drug molecules. Use the modify_molecule tool to make minimal structural changes that improve the specified ADMET properties while preserving the scaffold.<|im_end|>
<|im_start|>user
Molecule: [N][C@@][Branch1][=Branch1][C][=Branch1][C][=O][O][C][C][C@H1][C@H1][B... | null | null | null | null |
<|im_start|>system
You are a medicinal chemist optimizing drug molecules. Use the modify_molecule tool to make minimal structural changes that improve the specified ADMET properties while preserving the scaffold.<|im_end|>
<|im_start|>user
Molecule: [C][C][Branch1][C][C][Branch1][=N][O][C][=C][C][=C][Branch1][C][Cl][C]... | null | null | null | null |
<|im_start|>system
You are a medicinal chemist optimizing drug molecules. Use the modify_molecule tool to make minimal structural changes that improve the specified ADMET properties while preserving the scaffold.<|im_end|>
<|im_start|>user
Molecule: [C][C][C][=Branch1][C][=O][N][C][C][C@@H1][C][C][C][=C][C][=C][C][=Bra... | null | null | null | null |
<|im_start|>system
You are a medicinal chemist optimizing drug molecules. Use the modify_molecule tool to make minimal structural changes that improve the specified ADMET properties while preserving the scaffold.<|im_end|>
<|im_start|>user
Molecule: [N][=C][Branch1][C][N][N][C][=Branch1][C][=O][C][C][=C][Branch1][C][Cl... | null | null | null | null |
<|im_start|>system
You are a medicinal chemist optimizing drug molecules. Use the modify_molecule tool to make minimal structural changes that improve the specified ADMET properties while preserving the scaffold.<|im_end|>
<|im_start|>user
Molecule: [N][C][=N][C][Branch1][=N][O][C][C][=C][C][Branch1][C][Br][=C][S][Ring... | null | null | null | null |
<|im_start|>system
You are a medicinal chemist optimizing drug molecules. Use the modify_molecule tool to make minimal structural changes that improve the specified ADMET properties while preserving the scaffold.<|im_end|>
<|im_start|>user
Molecule: [C][C][Branch1][C][C][C][=C][C][=C][O][C][=N][C][Branch1][C][N][=C][Br... | null | null | null | null |
<|im_start|>system
You are a medicinal chemist optimizing drug molecules. Use the modify_molecule tool to make minimal structural changes that improve the specified ADMET properties while preserving the scaffold.<|im_end|>
<|im_start|>user
Molecule: [C][O][/N][=C][Branch2][Ring2][Branch1][\C][=Branch1][C][=O][N][C@@H1]... | null | null | null | null |
<|im_start|>system
You are a medicinal chemist optimizing drug molecules. Use the modify_molecule tool to make minimal structural changes that improve the specified ADMET properties while preserving the scaffold.<|im_end|>
<|im_start|>user
Molecule: [C][O][C][=N][C][=N][C][Branch1][O][C][=N][O][C][Branch1][C][C][=N][Ri... | null | null | null | null |
<|im_start|>system
You are a medicinal chemist optimizing drug molecules. Use the modify_molecule tool to make minimal structural changes that improve the specified ADMET properties while preserving the scaffold.<|im_end|>
<|im_start|>user
Molecule: [C][C][=Branch1][C][=O][N][C][=C][C][=C][C][Branch2][Ring2][C][N][C][C... | null | null | null | null |
<|im_start|>system
You are a medicinal chemist optimizing drug molecules. Use the modify_molecule tool to make minimal structural changes that improve the specified ADMET properties while preserving the scaffold.<|im_end|>
<|im_start|>user
Molecule: [C][O][C][=C][C][=C][C][Branch1][S][C][=Branch1][C][=O][C][=C][C][=C][... | null | null | null | null |
<|im_start|>system
You are a medicinal chemist optimizing drug molecules. Use the modify_molecule tool to make minimal structural changes that improve the specified ADMET properties while preserving the scaffold.<|im_end|>
<|im_start|>user
Molecule: [O][=C][Branch1][O][N][C][=C][C][=C][C][=C][Ring1][=Branch1][F][N][C@H... | null | null | null | null |
<|im_start|>system
You are a medicinal chemist optimizing drug molecules. Use the modify_molecule tool to make minimal structural changes that improve the specified ADMET properties while preserving the scaffold.<|im_end|>
<|im_start|>user
Molecule: [C][C][C][=C][Branch1][#Branch1][C][C][=Branch1][C][=O][O][N][Branch1]... | null | null | null | null |
<|im_start|>system
You are a medicinal chemist optimizing drug molecules. Use the modify_molecule tool to make minimal structural changes that improve the specified ADMET properties while preserving the scaffold.<|im_end|>
<|im_start|>user
Molecule: [C][C][S][=Branch1][C][=O][=Branch1][C][=O][O][C][=C][C][=C][C][Branch... | null | null | null | null |
<|im_start|>system
You are a medicinal chemist optimizing drug molecules. Use the modify_molecule tool to make minimal structural changes that improve the specified ADMET properties while preserving the scaffold.<|im_end|>
<|im_start|>user
Molecule: [C][C][C][C][C][C][C][C][O]
Target: Solubility
Direction: {'Solubility... | null | null | null | null |
<|im_start|>system
You are a medicinal chemist optimizing drug molecules. Use the modify_molecule tool to make minimal structural changes that improve the specified ADMET properties while preserving the scaffold.<|im_end|>
<|im_start|>user
Molecule: [C][C][=C][C][=C][C][=Branch1][C][=O][C][=C][C][=C][C][Branch1][#Branc... | null | null | null | null |
<|im_start|>system
You are a medicinal chemist optimizing drug molecules. Use the modify_molecule tool to make minimal structural changes that improve the specified ADMET properties while preserving the scaffold.<|im_end|>
<|im_start|>user
Molecule: [C][C][NH1][C][Branch2][Ring1][Branch1][/C][=C][\C][=Branch1][C][=O][N... | null | null | null | null |
<|im_start|>system
You are a medicinal chemist optimizing drug molecules. Use the modify_molecule tool to make minimal structural changes that improve the specified ADMET properties while preserving the scaffold.<|im_end|>
<|im_start|>user
Molecule: [C][O][P][=Branch1][C][=O][Branch1][Ring1][O][C][O][C][Branch1][N][C][... | null | null | null | null |
<|im_start|>system
You are a medicinal chemist optimizing drug molecules. Use the modify_molecule tool to make minimal structural changes that improve the specified ADMET properties while preserving the scaffold.<|im_end|>
<|im_start|>user
Molecule: [N][C][=N][C][=C][Branch1][O][N][=C][N][Ring1][Branch1][C][O][C][C][O]... | null | null | null | null |
<|im_start|>system
You are a medicinal chemist optimizing drug molecules. Use the modify_molecule tool to make minimal structural changes that improve the specified ADMET properties while preserving the scaffold.<|im_end|>
<|im_start|>user
Molecule: [C][N][C][=Branch1][C][=O][C][O][C][=C][C][=C][C][=C][Ring1][=Branch1]... | null | null | null | null |
<|im_start|>system
You are a medicinal chemist optimizing drug molecules. Use the modify_molecule tool to make minimal structural changes that improve the specified ADMET properties while preserving the scaffold.<|im_end|>
<|im_start|>user
Molecule: [O][=C][Branch1][O][/C][=C][/C][=C][C][=C][C][=C][Ring1][=Branch1][N][... | null | null | null | null |
<|im_start|>system
You are a medicinal chemist optimizing drug molecules. Use the modify_molecule tool to make minimal structural changes that improve the specified ADMET properties while preserving the scaffold.<|im_end|>
<|im_start|>user
Molecule: [C][N][C][C][N][Branch2][Ring2][Ring1][C][C][C][N][C][=C][C][=C][C][=C... | null | null | null | null |
<|im_start|>system
You are a medicinal chemist optimizing drug molecules. Use the modify_molecule tool to make minimal structural changes that improve the specified ADMET properties while preserving the scaffold.<|im_end|>
<|im_start|>user
Molecule: [C][C][N][Branch1][Ring1][C][C][C][C][O][C][=C][C][=C][C][=Branch1][Ri... | null | null | null | null |
<|im_start|>system
You are a medicinal chemist optimizing drug molecules. Use the modify_molecule tool to make minimal structural changes that improve the specified ADMET properties while preserving the scaffold.<|im_end|>
<|im_start|>user
Molecule: [N][C][=Branch1][C][=O][C][N][=C][N][Branch1][S][C@@H1][O][C@H1][Branc... | null | null | null | null |
<|im_start|>system
You are a medicinal chemist optimizing drug molecules. Use the modify_molecule tool to make minimal structural changes that improve the specified ADMET properties while preserving the scaffold.<|im_end|>
<|im_start|>user
Molecule: [C][C][N][Branch1][Ring1][C][C][C][C][O][C][=Branch1][C][=O][C][Branch... | null | null | null | null |
<|im_start|>system
You are a medicinal chemist optimizing drug molecules. Use the modify_molecule tool to make minimal structural changes that improve the specified ADMET properties while preserving the scaffold.<|im_end|>
<|im_start|>user
Molecule: [C][N][C][C][C][C][Branch2][Ring1][#C][N][N][=C][Branch1][=N][C][C][=C... | null | null | null | null |
<|im_start|>system
You are a medicinal chemist optimizing drug molecules. Use the modify_molecule tool to make minimal structural changes that improve the specified ADMET properties while preserving the scaffold.<|im_end|>
<|im_start|>user
Molecule: [C][C][Branch1][C][C][Branch1][C][C][N][C][C@H1][Branch1][C][O][C][=C]... | null | null | null | null |
<|im_start|>system
You are a medicinal chemist optimizing drug molecules. Use the modify_molecule tool to make minimal structural changes that improve the specified ADMET properties while preserving the scaffold.<|im_end|>
<|im_start|>user
Molecule: [C][N][Branch1][C][C][C][=Branch1][C][=O][O][C][=C][C][=C][C][Branch1]... | null | null | null | null |
<|im_start|>system
You are a medicinal chemist optimizing drug molecules. Use the modify_molecule tool to make minimal structural changes that improve the specified ADMET properties while preserving the scaffold.<|im_end|>
<|im_start|>user
Molecule: [N][/N][=C][\NH1][NH1][/C][=Branch1][Ring1][=N][\N][C][=C][C][=C][C][=... | null | null | null | null |
<|im_start|>system
You are a medicinal chemist optimizing drug molecules. Use the modify_molecule tool to make minimal structural changes that improve the specified ADMET properties while preserving the scaffold.<|im_end|>
<|im_start|>user
Molecule: [N][C][=C][C][=C][Branch1][S][S][=Branch1][C][=O][=Branch1][C][=O][N][... | null | null | null | null |
<|im_start|>system
You are a medicinal chemist optimizing drug molecules. Use the modify_molecule tool to make minimal structural changes that improve the specified ADMET properties while preserving the scaffold.<|im_end|>
<|im_start|>user
Molecule: [C][=C][C][N][C][=Branch1][C][=O][N][Branch1][S][C@@H1][O][C@H1][Branc... | null | null | null | null |
<|im_start|>system
You are a medicinal chemist optimizing drug molecules. Use the modify_molecule tool to make minimal structural changes that improve the specified ADMET properties while preserving the scaffold.<|im_end|>
<|im_start|>user
Molecule: [C][C][N][Branch1][Ring1][C][C][C][C][C][C][Branch1][C][C][N][C][=C][C... | null | null | null | null |
<|im_start|>system
You are a medicinal chemist optimizing drug molecules. Use the modify_molecule tool to make minimal structural changes that improve the specified ADMET properties while preserving the scaffold.<|im_end|>
<|im_start|>user
Molecule: [C][N][C][=Branch1][C][=O][C][NH1][C][=N][C][=Ring1][Branch1][N][Branc... | null | null | null | null |
<|im_start|>system
You are a medicinal chemist optimizing drug molecules. Use the modify_molecule tool to make minimal structural changes that improve the specified ADMET properties while preserving the scaffold.<|im_end|>
<|im_start|>user
Molecule: [C][O][C][=C][C][=C][C][Branch1][S][C][=Branch1][C][=O][C][=C][C][=C][... | null | null | null | null |
<|im_start|>system
You are a medicinal chemist optimizing drug molecules. Use the modify_molecule tool to make minimal structural changes that improve the specified ADMET properties while preserving the scaffold.<|im_end|>
<|im_start|>user
Molecule: [C][N][C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][=C][N][=C][Rin... | null | null | null | null |
<|im_start|>system
You are a medicinal chemist optimizing drug molecules. Use the modify_molecule tool to make minimal structural changes that improve the specified ADMET properties while preserving the scaffold.<|im_end|>
<|im_start|>user
Molecule: [C][C][NH1][C][=Branch1][C][=O][C][Branch1][Ring1][C][#N][=C][C][=Ring... | null | null | null | null |
<|im_start|>system
You are a medicinal chemist optimizing drug molecules. Use the modify_molecule tool to make minimal structural changes that improve the specified ADMET properties while preserving the scaffold.<|im_end|>
<|im_start|>user
Molecule: [C][C][N][Branch1][Ring1][C][C][C][C][N][C][=Branch1][C][=O][C][=C][C]... | null | null | null | null |
<|im_start|>system
You are a medicinal chemist optimizing drug molecules. Use the modify_molecule tool to make minimal structural changes that improve the specified ADMET properties while preserving the scaffold.<|im_end|>
<|im_start|>user
Molecule: [C][O][/N][=C][\C][N][Branch2][Ring1][P][C][=N][C][=C][Branch1][=Branc... | null | null | null | null |
<|im_start|>system
You are a medicinal chemist optimizing drug molecules. Use the modify_molecule tool to make minimal structural changes that improve the specified ADMET properties while preserving the scaffold.<|im_end|>
<|im_start|>user
Molecule: [O-1][S+1][Branch2][Ring2][=Branch1][C][C][=C][C][Branch2][Ring1][=Bra... | null | null | null | null |
<|im_start|>system
You are a medicinal chemist optimizing drug molecules. Use the modify_molecule tool to make minimal structural changes that improve the specified ADMET properties while preserving the scaffold.<|im_end|>
<|im_start|>user
Molecule: [C][C][=Branch1][C][=O][O][C][C][=C][Branch1][=Branch1][C][=Branch1][C... | null | null | null | null |
<|im_start|>system
You are a medicinal chemist optimizing drug molecules. Use the modify_molecule tool to make minimal structural changes that improve the specified ADMET properties while preserving the scaffold.<|im_end|>
<|im_start|>user
Molecule: [C][O][C][=Branch1][C][=S][N][C][C][N][C][Branch1][=Branch1][N+1][=Bra... | null | null | null | null |
<|im_start|>system
You are a medicinal chemist optimizing drug molecules. Use the modify_molecule tool to make minimal structural changes that improve the specified ADMET properties while preserving the scaffold.<|im_end|>
<|im_start|>user
Molecule: [C][N+1][Branch1][C][C][Branch1][C][C][C][C][=Branch1][C][=O][O]
Targe... | null | null | null | null |
<|im_start|>system
You are a medicinal chemist optimizing drug molecules. Use the modify_molecule tool to make minimal structural changes that improve the specified ADMET properties while preserving the scaffold.<|im_end|>
<|im_start|>user
Molecule: [C][C][Branch1][C][C][N][C][=C][C][=C][N][=C][Ring1][=Branch1][N][C][C... | null | null | null | null |
<|im_start|>system
You are a medicinal chemist optimizing drug molecules. Use the modify_molecule tool to make minimal structural changes that improve the specified ADMET properties while preserving the scaffold.<|im_end|>
<|im_start|>user
Molecule: [O][=C][Branch2][Ring1][=C][C][C][C][N][C][C][C][Branch1][P][N][C][=Br... | null | null | null | null |
<|im_start|>system
You are a medicinal chemist optimizing drug molecules. Use the modify_molecule tool to make minimal structural changes that improve the specified ADMET properties while preserving the scaffold.<|im_end|>
<|im_start|>user
Molecule: [C][N][C][C][C@H1][Branch2][Ring2][Ring2][C][=C][Branch1][C][O][C][=C]... | null | null | null | null |
<|im_start|>system
You are a medicinal chemist optimizing drug molecules. Use the modify_molecule tool to make minimal structural changes that improve the specified ADMET properties while preserving the scaffold.<|im_end|>
<|im_start|>user
Molecule: [C][O][C][=C][C][=C][Branch2][Ring1][Ring2][N][S][=Branch1][C][=O][=Br... | null | null | null | null |
<|im_start|>system
You are a medicinal chemist optimizing drug molecules. Use the modify_molecule tool to make minimal structural changes that improve the specified ADMET properties while preserving the scaffold.<|im_end|>
<|im_start|>user
Molecule: [C][C][C][N][C][Branch1][C][C][C][=Branch1][C][=O][N][C][=C][C][=C][C]... | null | null | null | null |
<|im_start|>system
You are a medicinal chemist optimizing drug molecules. Use the modify_molecule tool to make minimal structural changes that improve the specified ADMET properties while preserving the scaffold.<|im_end|>
<|im_start|>user
Molecule: [C][C][N][C][=Branch1][C][=O][O][C][C][C][N][Branch2][Ring1][#Branch1]... | null | null | null | null |
<|im_start|>system
You are a medicinal chemist optimizing drug molecules. Use the modify_molecule tool to make minimal structural changes that improve the specified ADMET properties while preserving the scaffold.<|im_end|>
<|im_start|>user
Molecule: [N][C][=C][C][=C][Branch2][Ring1][Branch2][O][C][C][C][C][C][N][C][=Br... | null | null | null | null |
<|im_start|>system
You are a medicinal chemist optimizing drug molecules. Use the modify_molecule tool to make minimal structural changes that improve the specified ADMET properties while preserving the scaffold.<|im_end|>
<|im_start|>user
Molecule: [C][N][C][=Branch1][C][=O][C@@H1][Branch2][Ring1][Ring1][N][C][=Branch... | null | null | null | null |
<|im_start|>system
You are a medicinal chemist optimizing drug molecules. Use the modify_molecule tool to make minimal structural changes that improve the specified ADMET properties while preserving the scaffold.<|im_end|>
<|im_start|>user
Molecule: [C][C][=Branch1][C][=O][O][C][=C][Branch1][C][C][C][=C][Branch1][=C][O... | null | null | null | null |
<|im_start|>system
You are a medicinal chemist optimizing drug molecules. Use the modify_molecule tool to make minimal structural changes that improve the specified ADMET properties while preserving the scaffold.<|im_end|>
<|im_start|>user
Molecule: [C][C][O][C][=Branch1][C][=O][C@H1][Branch1][O][C][C][C][=C][C][=C][C]... | null | null | null | null |
<|im_start|>system
You are a medicinal chemist optimizing drug molecules. Use the modify_molecule tool to make minimal structural changes that improve the specified ADMET properties while preserving the scaffold.<|im_end|>
<|im_start|>user
Molecule: [O][=C][Branch1][=Branch2][C][N][C][=C][N][=C][Ring1][Branch1][C][=C][... | null | null | null | null |
<|im_start|>system
You are a medicinal chemist optimizing drug molecules. Use the modify_molecule tool to make minimal structural changes that improve the specified ADMET properties while preserving the scaffold.<|im_end|>
<|im_start|>user
Molecule: [C][C][N][C][C][C@H1][Branch1][C][O][C][N][C][C][C][C][N][C][C@@H1][Br... | null | null | null | null |
<|im_start|>system
You are a medicinal chemist optimizing drug molecules. Use the modify_molecule tool to make minimal structural changes that improve the specified ADMET properties while preserving the scaffold.<|im_end|>
<|im_start|>user
Molecule: [O][=N+1][Branch1][C][O-1][C][=C][C][=C][Branch1][C][O][C][Branch1][=B... | null | null | null | null |
<|im_start|>system
You are a medicinal chemist optimizing drug molecules. Use the modify_molecule tool to make minimal structural changes that improve the specified ADMET properties while preserving the scaffold.<|im_end|>
<|im_start|>user
Molecule: [C][C@H1][C@H1][Branch1][=N][O][C][=Branch1][C][=O][C][C][C][=Branch1]... | null | null | null | null |
<|im_start|>system
You are a medicinal chemist optimizing drug molecules. Use the modify_molecule tool to make minimal structural changes that improve the specified ADMET properties while preserving the scaffold.<|im_end|>
<|im_start|>user
Molecule: [C][C][Branch1][=Branch1][C][=Branch1][C][=O][O][C][=C][C][=C][Branch1... | null | null | null | null |
<|im_start|>system
You are a medicinal chemist optimizing drug molecules. Use the modify_molecule tool to make minimal structural changes that improve the specified ADMET properties while preserving the scaffold.<|im_end|>
<|im_start|>user
Molecule: [O][=C][Branch2][Ring1][=Branch2][N][C@H1][C][C][S][C@H1][C][C][C][C@@... | null | null | null | null |
<|im_start|>system
You are a medicinal chemist optimizing drug molecules. Use the modify_molecule tool to make minimal structural changes that improve the specified ADMET properties while preserving the scaffold.<|im_end|>
<|im_start|>user
Molecule: [C][N][C@H1][Branch2][Ring2][N][C][=Branch1][C][=O][N][C@H1][Branch2][... | null | null | null | null |
<|im_start|>system
You are a medicinal chemist optimizing drug molecules. Use the modify_molecule tool to make minimal structural changes that improve the specified ADMET properties while preserving the scaffold.<|im_end|>
<|im_start|>user
Molecule: [N][C][C][C][S][=Branch1][C][=O][=Branch1][C][=O][O]
Target: hERG
Dire... | null | null | null | null |
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