CHEMBL262172


SMILES CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)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 LTNSZIYAGMZDDY-QMXRFRSXSA-N

Chemical properties

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

Drug properties

Molecular type Protein
Endogenous/Surrogate Surrogate
Approved drug No

Database connections

Bioactivities

Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
CCK1 CCKAR Human Cholecystokinin A pKi 5.24 5.24 5.24 ChEMBL
CCK2 GASR Human Cholecystokinin A pKi 6.82 6.82 6.82 ChEMBL
δ OPRD Human Opioid A pKi 9.66 9.66 9.66 ChEMBL
μ OPRM Rat Opioid A pKi 8.11 8.11 8.11 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
CCK1 CCKAR Human Cholecystokinin A pIC50 5.24 5.24 5.24 ChEMBL
CCK2 GASR Human Cholecystokinin A pEC50 8.1 8.1 8.1 ChEMBL
CCK2 GASR Human Cholecystokinin A pIC50 6.84 6.84 6.84 ChEMBL
δ OPRD Human Opioid A pEC50 8.23 8.23 8.23 ChEMBL
δ OPRD Human Opioid A pIC50 9.28 9.28 9.28 ChEMBL
δ OPRD Mouse Opioid A pIC50 7.35 7.35 7.35 ChEMBL
μ OPRM Rat Opioid A pEC50 7.92 7.92 7.93 ChEMBL
μ OPRM Rat Opioid A pIC50 7.74 7.74 7.74 ChEMBL