CHEMBL318852


SMILES CC(Cc1c[nH]c2ccccc12)(C(=O)OC1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2)C(=O)N(CCc1ccc(Cl)cc1Cl)CC(=O)O
InChIKey UIISAWYHPZCXHX-VKXCFGGISA-N

Chemical properties

Hydrogen bond acceptors 4
Hydrogen bond donors 2
Rotatable bonds 10
Molecular weight (Da) 610.2

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 Rat Cholecystokinin A pKi 7.55 7.55 7.55 ChEMBL
CCK2 GASR Mouse Cholecystokinin A pKi 7.85 7.85 7.85 ChEMBL
CCK1 CCKAR Guinea pig Cholecystokinin A pKi 5.52 5.52 5.52 ChEMBL
CCK1 CCKAR Rat Cholecystokinin A pKi 5.91 5.91 5.91 ChEMBL
CCK2 GASR Human Cholecystokinin A pKi 7.91 7.91 7.91 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database