Molecule ID: 3045227

IUPAC Name: (2S)-1-(6-chloro-5-fluoroindol-1-yl)propan-2-amine

Description: The molecule is a 1-(6-chloro-5-fluoroindol-1-yl)-propan-2-amine that has S configuration. A selective agonist for both the 5-hydroxytryptamine 2B (5-HT2B) and 5-hydroxytryptamine 2C (5-HT2C)serotonin receptor subtypes, commonly used as fumarate salt. It has a role as a 5-hydroxytryptamine 2B receptor agonist and a 5-hydroxytryptamine 2C receptor agonist.

SMILES: C[C@H](N)Cn1ccc2cc(F)c(Cl)cc21

SELFIES: [C][C@H1][Branch1][C][N][C][N][C][=C][C][=C][C][Branch1][C][F][=C][Branch1][C][Cl][C][=C][Ring1][Branch2][Ring1][O]

InChI: InChI=1S/C11H12ClFN2/c1-7(14)6-15-3-2-8-4-10(13)9(12)5-11(8)15/h2-5,7H,6,14H2,1H3/t7-/m0/s1

Molecular Properties:
- Polar Surface Area: 31.0 Ų
- LogP: 2.2