CHEMBL1649941


SMILES CCCC[C@@H](NC(=O)[C@@H](N)Cc1c(C)cc(O)cc1C)C(=O)NCC(=O)N[C@@H](Cc1ccc(Cl)cc1)C(=O)N1CCC(N(C(=O)CC)c2ccccc2)CC1
InChIKey QOTSIQBGDAQKCQ-QOEXFKEZSA-N

Chemical properties

Hydrogen bond acceptors 7
Hydrogen bond donors 5
Rotatable bonds 17
Molecular weight (Da) 774.4

Drug properties

Molecular type Small molecule
Endogenous/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 10.0 10.0 10.0 ChEMBL
δ OPRD Human Opioid A pKi 10.1 10.1 10.1 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
δ OPRD Mouse Opioid A pIC50 8.72 8.72 8.72 ChEMBL
μ OPRM Rat Opioid A pIC50 9.71 9.71 9.71 ChEMBL
μ OPRM Rat Opioid A pEC50 9.85 9.85 9.85 ChEMBL
δ OPRD Human Opioid A pEC50 10.15 10.17 10.19 ChEMBL
δ OPRD Human Opioid A pIC50 9.73 9.73 9.73 ChEMBL