CHEMBL3139163


SMILES Oc1ccc2c(c1)[C@]13CCN(C[C@@H]4CCCO4)[C@H](C2)[C@]1(O)Cc1cc2ccccc2nc1C3
InChIKey GEZCLAKVGCBGTG-YWLJMITFSA-N

Chemical properties

Hydrogen bond acceptors 5
Hydrogen bond donors 2
Rotatable bonds 2
Molecular weight (Da) 442.2

Drug properties

Molecular type Small molecule
Endogenous/Surrogate Surrogate
Approved drug No

Bioactivities

Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
δ OPRD Mouse Opioid A pKi 9.59 9.59 9.59 ChEMBL
κ OPRK Guinea pig Opioid A pKi 8.88 8.88 8.88 ChEMBL
μ OPRM Mouse Opioid A pKi 8.13 8.13 8.13 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
δ OPRD Human Opioid A pEC50 8.87 8.87 8.87 ChEMBL
κ OPRK Human Opioid A pEC50 7.57 7.57 7.57 ChEMBL
μ OPRM Human Opioid A pEC50 7.82 7.82 7.82 ChEMBL