CHEMBL4115338


SMILES C=Cc1ccc2c3c1O[C@@H]1[C@]34CCN(C)[C@H](C2)[C@]42CC[C@@]1(OC)[C@@H](COCc1ccccc1)C2
InChIKey SXOUMZNAELVZJJ-YFMBSZHDSA-N

Chemical properties

Hydrogen bond acceptors 4
Hydrogen bond donors 0
Rotatable bonds 6
Molecular weight (Da) 457.3

Drug properties

Molecular type Small molecule
Endogenous/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 6.76 6.76 6.76 ChEMBL
κ OPRK Human Opioid A pKi 9.64 9.64 9.64 ChEMBL
μ OPRM Human Opioid A pKi 7.79 7.79 7.79 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
δ OPRD Human Opioid A pEC50 6.72 6.72 6.72 ChEMBL
κ OPRK Human Opioid A pEC50 8.17 8.17 8.17 ChEMBL
μ OPRM Human Opioid A pEC50 7.73 7.73 7.73 ChEMBL