CHEMBL399465


SMILES C[C@H]1C2Cc3ccc(C(=O)NCCc4ccccc4-c4ccccc4)cc3[C@@]1(C)CCN2CC1CC1
InChIKey VHBQYOYZNDRQMW-CHCCDMOGSA-N

Chemical properties

Hydrogen bond acceptors 2
Hydrogen bond donors 1
Rotatable bonds 7
Molecular weight (Da) 478.3

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
δ OPRD Human Opioid A pKi 7.68 7.68 7.68 ChEMBL
κ OPRK Human Opioid A pKi 8.62 8.62 8.62 ChEMBL
μ OPRM Human Opioid A pKi 8.17 8.17 8.17 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
κ OPRK Human Opioid A pEC50 7.38 7.38 7.38 ChEMBL
μ OPRM Human Opioid A pEC50 7.92 7.92 7.92 ChEMBL