Molecule ID: 447966

IUPAC Name: 4-(5-pyridin-2-yl-1H-pyrazol-4-yl)quinoline

Description: The molecule is a member of the class of pyrazoles carrying pyridin-2-yl and quinolin-4-yl substituents at positions 3 and 4 respectively. It has a role as a TGFbeta receptor antagonist. It is a member of pyrazoles, a member of pyridines and a member of quinolines.

SMILES: c1ccc(-c2n[nH]cc2-c2ccnc3ccccc23)nc1

SELFIES: [C][=C][C][=C][Branch2][Ring1][=Branch1][C][=N][NH1][C][=C][Ring1][Branch1][C][=C][C][=N][C][=C][C][=C][C][=C][Ring1][#Branch2][Ring1][=Branch1][N][=C][Ring2][Ring1][Branch1]

InChI: InChI=1S/C17H12N4/c1-2-6-15-13(5-1)12(8-10-19-15)14-11-20-21-17(14)16-7-3-4-9-18-16/h1-11H,(H,20,21)

Molecular Properties:
- Polar Surface Area: 54.5 Ų
- LogP: 2.7