CHEMBL1172251


SMILES CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O
InChIKey ZUUGDHAKGUQZKD-IDLZVHLMSA-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 7.75 7.75 7.75 ChEMBL
CCK1 CCKAR Human Cholecystokinin A pKi 5.85 5.85 5.85 ChEMBL
μ OPRM Rat Opioid A pKi 7.85 7.85 7.85 ChEMBL
δ OPRD Human Opioid A pKi 8.21 8.21 8.21 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
δ OPRD Mouse Opioid A pIC50 7.4 7.4 7.4 ChEMBL
CCK2 GASR Human Cholecystokinin A pIC50 7.5 7.5 7.5 ChEMBL
CCK1 CCKAR Human Cholecystokinin A pIC50 5.6 5.6 5.6 ChEMBL
μ OPRM Rat Opioid A pIC50 7.5 7.5 7.5 ChEMBL
MC4 MC4R Human Melanocortin A pIC50 5.89 5.89 5.9 ChEMBL
δ OPRD Human Opioid A pIC50 7.9 7.9 7.9 ChEMBL