CHEMBL3264748


SMILES O=C1[C@H]2O[C@@]34CC[C@@]5(OCOc6c(O)ccc7c6[C@@]3(CCN(CC3CC3)[C@@H]4C7)[C@H]25)N1CCc1ccccc1
InChIKey ASWPFFLMSHOYIM-NLIGWKNISA-N

Chemical properties

Hydrogen bond acceptors 6
Hydrogen bond donors 1
Rotatable bonds 5
Molecular weight (Da) 514.2

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 8.76 8.76 8.76 ChEMBL
δ OPRD Mouse Opioid A pKi 8.94 8.94 8.94 ChEMBL
κ OPRK Guinea pig Opioid A pKi 8.71 8.71 8.71 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
δ OPRD Human Opioid A pEC50 9.21 9.3 9.39 ChEMBL
κ OPRK Human Opioid A pEC50 8.41 8.52 8.62 ChEMBL
μ OPRM Human Opioid A pEC50 8.28 8.48 8.68 ChEMBL