CHEMBL3754081


SMILES CCC(=O)N(CC1CCCCN1[C@@H](Cc1ccccc1)C(=O)NCC(=O)N[C@H](C)C(=O)N[C@@H](Cc1c(C)cc(O)cc1C)C(=O)O)c1ccccc1
InChIKey ZRGJOXHHIRWPHY-AXCNTNFBSA-N

Chemical properties

Hydrogen bond acceptors 7
Hydrogen bond donors 5
Rotatable bonds 16
Molecular weight (Da) 713.4

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 9.1 9.1 9.1 ChEMBL
δ OPRD Human Opioid A pKi 9.7 9.7 9.7 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
δ OPRD Mouse Opioid A pIC50 9.33 9.33 9.33 ChEMBL
μ OPRM Rat Opioid A pIC50 8.76 8.76 8.76 ChEMBL
δ OPRD Human Opioid A pIC50 9.28 9.28 9.28 ChEMBL