CHEMBL408330


SMILES CCCC[C@@H](C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O)N(C)C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@@H](CCCC)NC(=O)[C@@H](N)Cc1ccc(O)cc1
InChIKey KJQHRGYUFQCLJG-ACEPAJJMSA-N

Chemical properties

Hydrogen bond acceptors None
Hydrogen bond donors None
Rotatable bonds None
Molecular weight (Da)

Drug properties

Molecular type Protein
Physiological/Surrogate Surrogate
Approved drug No

Database connections

Bioactivities

Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
CCK2 GASR Human Cholecystokinin A pKi 8.42 8.42 8.42 ChEMBL
μ OPRM Rat Opioid A pKi 7.6 7.6 7.6 ChEMBL
δ OPRD Human Opioid A pKi 8.7 8.7 8.7 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
δ OPRD Mouse Opioid A pIC50 8.05 8.05 8.05 ChEMBL
CCK2 GASR Human Cholecystokinin A pEC50 7.72 7.72 7.72 ChEMBL
CCK2 GASR Human Cholecystokinin A pIC50 8.42 8.42 8.42 ChEMBL
μ OPRM Rat Opioid A pIC50 7.23 7.23 7.23 ChEMBL
μ OPRM Rat Opioid A pEC50 6.96 6.96 6.96 ChEMBL
δ OPRD Human Opioid A pEC50 7.82 7.82 7.82 ChEMBL
δ OPRD Human Opioid A pIC50 8.33 8.33 8.33 ChEMBL