CHEMBL332261


SMILES CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H]1CCCN2C(=O)N(Cc3ccccc3)C(=O)C[C@@H]12
InChIKey JRSRZYFBWXHHNX-GSDHBNRESA-N

Chemical properties

Hydrogen bond acceptors 5
Hydrogen bond donors 3
Rotatable bonds 7
Molecular weight (Da) 559.3

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 9.21 9.21 9.21 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
CCK1 CCKAR Rat Cholecystokinin A pIC50 7.64 7.64 7.64 ChEMBL
CCK1 CCKAR Human Cholecystokinin A pIC50 4.68 4.92 5.16 ChEMBL
CCK2 GASR Human Cholecystokinin A pIC50 5.22 5.22 5.22 ChEMBL
CCK2 GASR Rat Cholecystokinin A pIC50 5.21 5.21 5.21 ChEMBL