CHEMBL393648


SMILES O[C@@H](CNC1CCCCC1)COc1cccc2[nH]ccc12
InChIKey PITGAFMHSKTZOO-AWEZNQCLSA-N

Chemical properties

Hydrogen bond acceptors 3
Hydrogen bond donors 3
Rotatable bonds 6
Molecular weight (Da) 288.2

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
β1 ADRB1 Human Adrenoceptors A pKi 8.62 8.62 8.62 ChEMBL
β2 ADRB2 Human Adrenoceptors A pKi 8.43 8.43 8.43 ChEMBL
5-HT1A 5HT1A Human 5-Hydroxytryptamine A pKi 8.18 8.53 8.88 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database