CHEMBL384118


SMILES COc1ccc2c3c1O[C@H]1C(=O)CC[C@@]4(NC/C=C/Cc5ccc(Cl)cc5)[C@@H](C2)N(CC2CC2)CC[C@]314
InChIKey WNTWXBMTVNDDJZ-HFLONSNSSA-N

Chemical properties

Hydrogen bond acceptors 5
Hydrogen bond donors 1
Rotatable bonds 8
Molecular weight (Da) 518.2

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 7.02 7.02 7.02 ChEMBL
κ OPRK Human Opioid A pKi 7.59 7.59 7.59 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
δ OPRD Human Opioid A pIC50 7.01 7.01 7.01 ChEMBL
κ OPRK Human Opioid A pIC50 6.41 6.41 6.41 ChEMBL
μ OPRM Human Opioid A pIC50 8.3 8.3 8.3 ChEMBL