CHEMBL202861


SMILES O=C(Nc1ccccc1C(=O)NC(Cc1ccccc1)C(=O)O)c1cc2ccccc2[nH]1
InChIKey GXZXQTARIHFJCZ-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 3
Hydrogen bond donors 4
Rotatable bonds 7
Molecular weight (Da) 427.2

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
CCK2 GASR Human Cholecystokinin A pKi 4.66 4.66 4.66 ChEMBL
CCK1 CCKAR Human Cholecystokinin A pKi 7.22 7.36 7.5 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
CCK1 CCKAR Guinea pig Cholecystokinin A pIC50 4.79 4.79 4.79 ChEMBL
CCK1 CCKAR Rat Cholecystokinin A pIC50 6.71 6.71 6.71 ChEMBL
CCK1 CCKAR Human Cholecystokinin A pIC50 6.71 6.71 6.71 ChEMBL