Chembl147511


SMILES O=C(CCCCCCCCC(=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 LWMXWHIOMHIBJP-SPKNWQAQSA-N

Chemical properties

Hydrogen bond acceptors 6
Hydrogen bond donors 0
Rotatable bonds 15
Molecular weight (Da) 788.5

Drug properties

Molecular type Small molecule
Endogenous/Surrogate Surrogate
Approved drug No

Database connections


Bioactivity

Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
δ OPRD Human Opioid A pKi 8.38 8.38 8.38 ChEMBL
κ OPRK Human Opioid A pKi 10.31 10.31 10.31 ChEMBL
κ OPRK Human Opioid A pEC50 9.07 9.07 9.07 ChEMBL
μ OPRM Human Opioid A pKi 10.05 10.05 10.05 ChEMBL
μ OPRM Human Opioid A pEC50 8.89 8.89 8.89 ChEMBL
μ OPRM Human Opioid A pIC50 7.8 7.8 7.8 ChEMBL