Molecule ID: 135398517

IUPAC Name: 8-hydroxy-2-methyl-3H-quinazolin-4-one

Description: The molecule is a member of the class of quinazolines that is quinazolin-4(1H)-one substituted by a hydroxy group at position 8 and a methyl group at position 2. It has been shown to exhibit inhibitory activity against poly(ADP-ribose) polymerase. It has a role as an EC 2.4.2.30 (NAD(+) ADP-ribosyltransferase) inhibitor. It is a member of quinazolines and a member of phenols.

SMILES: Cc1nc(O)c2cccc(O)c2n1

SELFIES: [C][C][=N][C][Branch1][C][O][=C][C][=C][C][=C][Branch1][C][O][C][Ring1][#Branch1][=N][Ring1][N]

InChI: InChI=1S/C9H8N2O2/c1-5-10-8-6(9(13)11-5)3-2-4-7(8)12/h2-4,12H,1H3,(H,10,11,13)

Molecular Properties:
- Polar Surface Area: 61.7 Ų
- LogP: 0.3