CHEMBL4531563


SMILES CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)C/C=C(\F)[C@@H](N)Cc1ccc(O)cc1)C(=O)O
InChIKey ICJHHSVEWAJXJP-ICXILOJFSA-N

Chemical properties

Hydrogen bond acceptors 6
Hydrogen bond donors 6
Rotatable bonds 15
Molecular weight (Da) 556.3

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 7.59 7.59 7.59 ChEMBL
μ OPRM Human Opioid A pKi 7.37 7.37 7.37 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
δ OPRD Mouse Opioid A pIC50 7.47 7.47 7.47 ChEMBL
δ OPRD Human Opioid A pEC50 6.12 7.21 8.3 ChEMBL
μ OPRM Human Opioid A pEC50 4.49 5.86 7.22 ChEMBL
μ OPRM Mouse Opioid A pIC50 6.4 6.42 6.44 ChEMBL