CHEMBL2387338


SMILES CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)NCC(=O)N(c1ccccc1)C1CCN(CCc2ccccc2)CC1
InChIKey WRWJIXPKEOGFRL-SVWSIEHRSA-N

Chemical properties

Hydrogen bond acceptors 9
Hydrogen bond donors 7
Rotatable bonds 22
Molecular weight (Da) 874.5

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
μ OPRM Rat Opioid A pKi 10.05 10.05 10.05 ChEMBL
δ OPRD Human Opioid A pKi 7.92 7.92 7.92 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
δ OPRD Mouse Opioid A pIC50 6.75 6.75 6.75 ChEMBL
μ OPRM Rat Opioid A pEC50 7.35 7.35 7.35 ChEMBL
δ OPRD Human Opioid A pEC50 7.43 7.43 7.43 ChEMBL