CHEMBL4749747


SMILES CCCCCCCCCCCCCCCC(=O)NCCCN1C(=O)CC(SC[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCSC)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc2c[nH]cn2)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](CCSC)NC(=O)[C@@H](N)Cc2ccc(O)cc2)C(N)=O)C1=O
InChIKey PXKVDJONXZSCHP-FVSZKLDUSA-N

Chemical properties

Hydrogen bond acceptors 18
Hydrogen bond donors 13
Rotatable bonds 52
Molecular weight (Da) 1449.7

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
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
δ OPRD Human Opioid A pEC50 7.65 8.17 8.69 ChEMBL
μ OPRM Human Opioid A pEC50 7.29 7.36 7.42 ChEMBL