CHEMBL2402930


SMILES NC(=O)[C@@H]1C/N=C(/N2CCCCC2)NC[C@@H](NC(=O)[C@@H](N)Cc2ccc(O)cc2)C(=O)NCC(=O)N[C@@H](Cc2ccccc2)C(=O)N1
InChIKey AUFPKYMBJJTQQY-ASDGIDEWSA-N

Chemical properties

Hydrogen bond acceptors 10
Hydrogen bond donors 8
Rotatable bonds 7
Molecular weight (Da) 649.3

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
μ OPRM Rat Opioid A pKi 6.2 6.55 6.97 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
δ OPRD Mouse Opioid A pIC50 6.51 6.51 6.51 ChEMBL
μ OPRM Rat Opioid A pEC50 5.12 5.55 5.84 ChEMBL
μ OPRM Rat Opioid A pIC50 6.11 6.46 6.88 ChEMBL