CHEMBL215926


SMILES COc1ccc2c3c1O[C@H]1C(=O)CC[C@@]4(NCCCCc5ccc(Cl)cc5)[C@@H](C2)N(CC2CC2)CC[C@]314
InChIKey OCYYYXWLRMUURD-GDZAYFCTSA-N

Chemical properties

Hydrogen bond acceptors 5
Hydrogen bond donors 1
Rotatable bonds 9
Molecular weight (Da) 520.2

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
δ OPRD Human Opioid A pKi 7.25 7.25 7.25 ChEMBL
κ OPRK Human Opioid A pKi 7.38 7.38 7.38 ChEMBL
μ OPRM Human Opioid A pKi 8.65 8.65 8.65 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
δ OPRD Human Opioid A pIC50 7.21 7.21 7.21 ChEMBL
κ OPRK Human Opioid A pIC50 6.7 6.7 6.7 ChEMBL
μ OPRM Human Opioid A pIC50 8.84 8.84 8.84 ChEMBL