CHEMBL235107


SMILES C[C@@H](NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)NNC(=O)CCC(=O)NC1CCN(CCc2ccccc2)CC1
InChIKey DSXQNAAVJJDPAE-KUSJRIKGSA-N

Chemical properties

Hydrogen bond acceptors 9
Hydrogen bond donors 8
Rotatable bonds 18
Molecular weight (Da) 756.4

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 8.92 8.92 8.92 ChEMBL
δ OPRD Human Opioid A pKi 8.43 8.43 8.43 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
δ OPRD Mouse Opioid A pIC50 6.6 6.6 6.6 ChEMBL
μ OPRM Rat Opioid A pEC50 7.79 7.79 7.8 ChEMBL
μ OPRM Rat Opioid A pIC50 8.6 8.6 8.6 ChEMBL
δ OPRD Human Opioid A pEC50 7.54 7.54 7.54 ChEMBL
δ OPRD Human Opioid A pIC50 8.12 8.12 8.12 ChEMBL