Chembl2048773


SMILES Oc1ccc(CNc2ccc3c(c2)[C@@]24CCCC[C@H]2[C@@H](C3)N(CC2CC2)CC4)cc1
InChIKey JAMOJAWCNGJKHW-WYMJOSIYSA-N

Chemical properties

Hydrogen bond acceptors 3
Hydrogen bond donors 2
Rotatable bonds 5
Molecular weight (Da) 402.3

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 7.89 7.89 7.89 ChEMBL
κ OPRK Human Opioid A pEC50 8.74 8.74 8.74 ChEMBL
κ OPRK Human Opioid A pKi 9.57 9.57 9.57 ChEMBL
μ OPRM Human Opioid A pIC50 8.12 8.12 8.12 ChEMBL
μ OPRM Human Opioid A pKi 9.55 9.55 9.55 ChEMBL