CHEMBL3264746


SMILES O=C1[C@H]2O[C@@]34CC[C@@]5(OCOc6c(O)ccc7c6[C@@]3(CCN(CCc3ccccc3)[C@@H]4C7)[C@H]25)N1Cc1ccccc1
InChIKey BOWOPEVIHUYMAZ-KRGIVBCISA-N

Chemical properties

Hydrogen bond acceptors 6
Hydrogen bond donors 1
Rotatable bonds 5
Molecular weight (Da) 550.2

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
μ OPRM Mouse Opioid A pKi 7.34 7.34 7.34 ChEMBL
δ OPRD Mouse Opioid A pKi 8.59 8.59 8.59 ChEMBL
κ OPRK Guinea pig Opioid A pKi 6.23 6.23 6.23 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
δ OPRD Human Opioid A pEC50 7.69 7.87 8.04 ChEMBL
κ OPRK Human Opioid A pEC50 4.9 4.9 4.9 ChEMBL
μ OPRM Human Opioid A pEC50 6.19 7.42 8.64 ChEMBL