CHEMBL5086370


SMILES CCCC[C@@H](NC(=O)[C@@H](N)Cc1c(C)cc(O)cc1C)C(=O)NCC(=O)N[C@@H](Cc1ccc(F)cc1)C(=O)N1CCC(N(C(=O)CC)c2ccc(Cl)c(Cl)c2)CC1
InChIKey KZEKPERUEWEVSS-QOEXFKEZSA-N

Chemical properties

Hydrogen bond acceptors None
Hydrogen bond donors None
Rotatable bonds None
Molecular weight (Da)

Drug properties

Molecular type Na
Physiological/Surrogate Surrogate
Approved drug No

Database connections

Bioactivities

Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
μ OPRM Rat Opioid A pKi 8.68 8.68 8.68 ChEMBL
δ OPRD Human Opioid A pKi 9.24 9.24 9.24 ChEMBL
κ OPRK Human Opioid A pKi 8.82 8.82 8.82 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
μ OPRM Rat Opioid A pIC50 8.33 8.33 8.33 ChEMBL
δ OPRD Human Opioid A pIC50 8.9 8.9 8.9 ChEMBL
κ OPRK Human Opioid A pIC50 8.22 8.22 8.22 ChEMBL