CHEMBL554943


SMILES COc1cccc(N2C(C(C)=O)=NN(c3ccc(Cl)cc3)C2c2ccc(N3CCOCC3)cc2)c1
InChIKey AYULBOXVHKIVEG-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 7
Hydrogen bond donors 0
Rotatable bonds 6
Molecular weight (Da) 490.2

Drug properties

Molecular type Small molecule
Endogenous/Surrogate Surrogate
Approved drug No

Database connections

Bioactivities

Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
CB2 CNR2 Human Cannabinoid A pKi 5.41 5.41 5.41 ChEMBL
CB1 CNR1 Human Cannabinoid A pKi 6.64 6.64 6.64 ChEMBL
CB1 CNR1 Human Cannabinoid A pKi 6.64 6.64 6.64 PDSP Ki database
CB2 CNR2 Human Cannabinoid A pKi 5.41 5.41 5.41 PDSP Ki database
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
CB1 CNR1 Human Cannabinoid A pEC50 6.22 6.22 6.22 ChEMBL