Molecule ID: 64961

IUPAC Name: 9H-pyrido[3,4-b]indole

Description: The molecule is the parent compound of the beta-carbolines, a tricyclic structure comprising an indole ring system ortho- fused to C-3 and C-4 of a pyridine ring. It has a role as a marine metabolite and a fungal metabolite. It is a member of beta-carbolines and a mancude organic heterotricyclic parent.

SMILES: c1ccc2c(c1)[nH]c1cnccc12

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

InChI: InChI=1S/C11H8N2/c1-2-4-10-8(3-1)9-5-6-12-7-11(9)13-10/h1-7,13H

Molecular Properties:
- Polar Surface Area: 28.7 Ų
- LogP: 3.2