CHEMBL4063074


SMILES Cc1cc(C)cc(C2CCCN2Cc2ccc(Oc3ccc(C(N)=O)cc3F)cc2)c1
InChIKey ZHPMYDSXGRRERG-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 3
Hydrogen bond donors 1
Rotatable bonds 6
Molecular weight (Da) 418.2

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 6.98 7.01 7.04 ChEMBL
κ OPRK Human Opioid A pKi 7.85 7.88 7.92 ChEMBL
μ OPRM Human Opioid A pKi 7.03 7.04 7.04 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
δ OPRD Human Opioid A pIC50 6.96 6.99 7.02 ChEMBL
κ OPRK Human Opioid A pIC50 8.11 8.14 8.18 ChEMBL
μ OPRM Human Opioid A pIC50 7.53 7.59 7.65 ChEMBL