CHEMBL3221198


SMILES O=C1/C(=C/c2cccc(OCc3ccc(Cl)cc3)c2)N=C2SCCCCN12
InChIKey ZUALWPVGMXNPBN-UYRXBGFRSA-N

Chemical properties

Hydrogen bond acceptors 4
Hydrogen bond donors 0
Rotatable bonds 4
Molecular weight (Da) 398.1

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
CB1 CNR1 Rat Cannabinoid A pKi 6.09 6.09 6.09 ChEMBL
CB2 CNR2 Human Cannabinoid A pKi 5.38 5.38 5.38 ChEMBL
CB1 CNR1 Human Cannabinoid A pKi 6.6 6.6 6.6 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
GPR55 GPR55 Human GPR18, GPR55 and GPR119 A pEC50 4.97 4.97 4.97 ChEMBL