CHEMBL1649938


SMILES CCCC[C@@H](NC(=O)[C@@H](N)Cc1c(C)cc(O)cc1C)C(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC(N(C(=O)CC)c2ccccc2)CC1
InChIKey QVBNXGNXRIPRPX-QOEXFKEZSA-N

Chemical properties

Hydrogen bond acceptors 7
Hydrogen bond donors 5
Rotatable bonds 17
Molecular weight (Da) 740.4

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 9.41 9.41 9.41 ChEMBL
δ OPRD Human Opioid A pKi 9.74 9.74 9.74 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
δ OPRD Mouse Opioid A pIC50 9.16 9.16 9.16 ChEMBL
μ OPRM Rat Opioid A pIC50 9.06 9.06 9.06 ChEMBL
μ OPRM Rat Opioid A pEC50 9.95 9.96 9.96 ChEMBL
δ OPRD Human Opioid A pEC50 10.0 10.0 10.0 ChEMBL
δ OPRD Human Opioid A pIC50 9.42 9.42 9.42 ChEMBL