CHEMBL5185996


SMILES CN(C(=O)Cc1ccccc1)[C@@H]1C[C@]23CCN(CC4CC4)[C@H](Cc4ccc(O)cc42)[C@]32CC[C@@H]1O2
InChIKey KCDPGHGVBKHDSF-MMAVNDQVSA-N

Chemical properties

Hydrogen bond acceptors 4
Hydrogen bond donors 1
Rotatable bonds 5
Molecular weight (Da) 472.3

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 7.71 7.71 7.71 ChEMBL
κ OPRK Human Opioid A pKi 9.56 9.56 9.56 ChEMBL
μ OPRM Human Opioid A pKi 8.76 8.76 8.76 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
δ OPRD Human Opioid A pEC50 7.36 7.36 7.36 ChEMBL
κ OPRK Human Opioid A pEC50 8.07 8.07 8.07 ChEMBL
μ OPRM Human Opioid A pEC50 8.15 8.15 8.15 ChEMBL