CHEMBL357334


SMILES COC(=O)CCCCCCCCC(=O)Oc1ccc2c(c1)[C@@]13CCCC[C@H]1[C@@H](C2)N(CC1CCC1)CC3
InChIKey BHKXQYNUEGAIAZ-RTKAOUNRSA-N

Chemical properties

Hydrogen bond acceptors 5
Hydrogen bond donors 0
Rotatable bonds 12
Molecular weight (Da) 509.4

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 7.36 7.36 7.36 ChEMBL
κ OPRK Human Opioid A pKi 10.15 10.15 10.15 ChEMBL
μ OPRM Human Opioid A pKi 9.64 9.64 9.64 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
κ OPRK Human Opioid A pEC50 8.24 8.24 8.24 ChEMBL
μ OPRM Human Opioid A pIC50 6.89 6.89 6.89 ChEMBL
μ OPRM Human Opioid A pEC50 8.1 8.1 8.1 ChEMBL