CHEMBL3264744


SMILES CC(C)CN1CC[C@@]23c4c5ccc(O)c4OCO[C@]46CC[C@@]2(O[C@H](C(=O)N4Cc2ccccc2)[C@H]63)[C@H]1C5
InChIKey UPAZZKNYLSZQFB-HJGLZJKISA-N

Chemical properties

Hydrogen bond acceptors 6
Hydrogen bond donors 1
Rotatable bonds 4
Molecular weight (Da) 502.2

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 6.73 6.73 6.73 ChEMBL
δ OPRD Mouse Opioid A pKi 8.15 8.15 8.15 ChEMBL
κ OPRK Guinea pig Opioid A pKi 6.92 6.92 6.92 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
δ OPRD Human Opioid A pEC50 6.85 7.33 7.81 ChEMBL
κ OPRK Human Opioid A pEC50 6.12 6.3 6.48 ChEMBL
μ OPRM Human Opioid A pEC50 6.4 6.53 6.65 ChEMBL