CHEMBL217395


SMILES COc1ccc2c3c1O[C@H]1C(=O)CC[C@@]4(NC(=O)CCc5ccc(Cl)cc5)[C@@H](C2)N(CC2CC2)CC[C@]314
InChIKey UJSYTVDGBUQRBX-QVDUQQMDSA-N

Chemical properties

Hydrogen bond acceptors 5
Hydrogen bond donors 1
Rotatable bonds 7
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
κ OPRK Guinea pig Opioid A pKi 8.19 8.19 8.19 ChEMBL
δ OPRD Human Opioid A pKi 8.29 8.29 8.29 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
δ OPRD Human Opioid A pIC50 9.12 9.12 9.12 ChEMBL
κ OPRK Human Opioid A pIC50 9.54 9.54 9.54 ChEMBL
μ OPRM Human Opioid A pIC50 10.52 10.52 10.52 ChEMBL