CHEMBL27173


SMILES NCCc1c[nH]c2ccc3c(c12)CCCO3
InChIKey CRBUBLCOTKWRPR-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 2
Hydrogen bond donors 2
Rotatable bonds 2
Molecular weight (Da) 216.1

Drug properties

Molecular type Small molecule
Physiological/Surrogate Surrogate
Approved drug No

Database connections

Bioactivities

Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
5-HT1A 5HT1A Rat 5-Hydroxytryptamine A pKi 6.52 6.52 6.52 ChEMBL
5-HT2B 5HT2B Human 5-Hydroxytryptamine A pKi 7.85 7.85 7.85 ChEMBL
5-HT2C 5HT2C Human 5-Hydroxytryptamine A pKi 8.2 8.2 8.2 ChEMBL
5-HT2A 5HT2A Human 5-Hydroxytryptamine A pKi 8.31 8.31 8.31 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
5-HT1D 5HT1D Human 5-Hydroxytryptamine A pIC50 6.96 6.96 6.96 ChEMBL
5-HT1A 5HT1A Rat 5-Hydroxytryptamine A pIC50 6.21 6.21 6.21 ChEMBL
5-HT2C 5HT2C Human 5-Hydroxytryptamine A pIC50 7.39 7.39 7.39 ChEMBL
5-HT1A 5HT1A Human 5-Hydroxytryptamine A pIC50 6.54 6.54 6.54 ChEMBL