Molecule ID: 1340

IUPAC Name: 5-hydroxy-2H-isoquinolin-1-one

Description: The molecule is an isoquinolinol that is isoquinoline in which the hydrogens at positions 1 and 5 are replaced by hydroxy groups. It has a role as an EC 2.4.2.30 (NAD(+) ADP-ribosyltransferase) inhibitor.

SMILES: Oc1cccc2c(O)nccc12

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

InChI: InChI=1S/C9H7NO2/c11-8-3-1-2-7-6(8)4-5-10-9(7)12/h1-5,11H,(H,10,12)

Molecular Properties:
- Polar Surface Area: 49.3 Ų
- LogP: 1.0