CHEMBL5094499


SMILES CCC(=O)N(c1ccc(Cl)c(Cl)c1)C1CCN(C(=O)[C@H](Cc2ccc(Cl)cc2)NC(=O)CNC(=O)[C@H]2Cc3ccccc3CN2C(=O)[C@@H](N)Cc2cc(C)c(O)c(C)c2)CC1
InChIKey JVAGZHNHHXCZDH-XUTHUYCTSA-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 8.26 8.26 8.26 ChEMBL
δ OPRD Human Opioid A pKi 9.27 9.27 9.27 ChEMBL
κ OPRK Human Opioid A pKi 9.28 9.28 9.28 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
μ OPRM Rat Opioid A pIC50 7.91 7.91 7.91 ChEMBL
δ OPRD Human Opioid A pIC50 8.93 8.93 8.93 ChEMBL
κ OPRK Human Opioid A pIC50 8.72 8.72 8.72 ChEMBL