CHEMBL237572


SMILES OC(CNC12CC3CC(CC(C3)C1)C2)COc1cccc2[nH]ccc12
InChIKey NILCXRPLMSLFEG-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 3
Hydrogen bond donors 3
Rotatable bonds 6
Molecular weight (Da) 340.2

Drug properties

Molecular type Small molecule
Physiological/Surrogate Surrogate
Approved drug No

Database connections

Sankey plot

Compound is not listed as a drug.

Bioactivities

Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
5-HT1A 5HT1A Human 5-Hydroxytryptamine A pKi 8.03 8.07 8.11 ChEMBL
5-HT1A 5HT1A Human 5-Hydroxytryptamine A pKi 7.52 8.02 8.41 PDSP Ki database
β1 ADRB1 Human Adrenoceptors A pKi 8.1 8.1 8.1 PDSP Ki database
β2 ADRB2 Human Adrenoceptors A pKi 8.18 8.18 8.18 PDSP Ki database
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database