CHEMBL9485


SMILES CCCCCN(CCCCC)C(=O)[C@@H](CCC(=O)O)NC(=O)c1ccc(Cl)c(Cl)c1
InChIKey IEKOTSCYBBDIJC-LJQANCHMSA-N

Chemical properties

Hydrogen bond acceptors 3
Hydrogen bond donors 2
Rotatable bonds 14
Molecular weight (Da) 458.2

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
CCK1 CCKAR Rat Cholecystokinin A pKi 7.31 7.31 7.31 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
CCK2 GASR Mouse Cholecystokinin A pIC50 5.52 5.52 5.52 ChEMBL
CCK1 CCKAR Guinea pig Cholecystokinin A pIC50 4.91 6.42 7.18 ChEMBL
CCK1 CCKAR Rat Cholecystokinin A pIC50 7.3 7.3 7.3 ChEMBL
CCK2 GASR Human Cholecystokinin A pIC50 5.25 5.25 5.25 ChEMBL