CHEMBL607069


SMILES COc1ccc2c3c1O[C@H]1C(=O)CC[C@@]4(NC(=O)/C=C/c5ccc(Cl)cc5)[C@@H](C2)N(C)CC[C@]314
InChIKey LCRBGGVXFPUISF-UXWNPHPLSA-N

Chemical properties

Hydrogen bond acceptors 5
Hydrogen bond donors 1
Rotatable bonds 4
Molecular weight (Da) 478.2

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
δ OPRD Human Opioid A pKi 9.0 9.0 9.0 ChEMBL
κ OPRK Human Opioid A pKi 8.19 8.19 8.19 ChEMBL
μ OPRM Human Opioid A pKi 9.22 9.22 9.22 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
δ OPRD Human Opioid A pEC50 8.3 8.3 8.3 ChEMBL
κ OPRK Human Opioid A pEC50 7.46 7.46 7.46 ChEMBL
μ OPRM Human Opioid A pEC50 9.05 9.05 9.05 ChEMBL