CHEMBL405131


SMILES O=C(CCCCCCC(=O)Oc1ccc2c(c1)[C@@]13CCCC[C@H]1[C@@H](C2)N(CC1CCC1)CC3)Oc1ccc2c(c1)[C@@]13CCCC[C@H]1[C@@H](C2)N(CC1CCC1)CC3
InChIKey ZLZOQZBMSGPYPY-UBHOSDFBSA-N

Chemical properties

Hydrogen bond acceptors 6
Hydrogen bond donors 0
Rotatable bonds 13
Molecular weight (Da) 760.5

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
δ OPRD Human Opioid A pKi 7.62 7.62 7.62 ChEMBL
κ OPRK Human Opioid A pKi 9.19 9.19 9.19 ChEMBL
μ OPRM Human Opioid A pKi 9.05 9.05 9.05 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
κ OPRK Human Opioid A pEC50 7.96 7.96 7.96 ChEMBL
μ OPRM Human Opioid A pIC50 7.05 7.05 7.05 ChEMBL
μ OPRM Human Opioid A pEC50 8.0 8.0 8.0 ChEMBL