CHEMBL1087721


SMILES O=C(NN1CCCCC1)c1nc(-c2ccc(Cl)cc2Cl)n(-c2ccc(Cl)cc2)c1CO
InChIKey PHWDIDWKGGEYRL-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 5
Hydrogen bond donors 2
Rotatable bonds 5
Molecular weight (Da) 478.1

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 Human Cannabinoid A pKi 7.47 7.47 7.47 ChEMBL
CB1 CNR1 Human Cannabinoid A pKd 8.4 8.4 8.4 ChEMBL
CB1 CNR1 Human Cannabinoid A pKi 7.47 7.47 7.47 PDSP Ki database
CB2 CNR2 Human Cannabinoid A pKi 5.12 5.12 5.12 PDSP Ki database
CB2 CNR2 Human Cannabinoid A pKi 5.12 5.12 5.12 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database