CHEMBL195007


SMILES Cc1cc(C)c(-c2nc(C(=O)Nc3ccc(C)c(C(=O)O)c3)c(CCC34CC5CC(CC(C5)C3)C4)[nH]2)c(C)c1
InChIKey MYYQAPSPAKFHPX-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 3
Hydrogen bond donors 3
Rotatable bonds 7
Molecular weight (Da) 525.3

Drug properties

Molecular type Small molecule
Endogenous/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 pKd 8.48 8.48 8.48 ChEMBL
CCK1 CCKAR Guinea pig Cholecystokinin A pKi 6.91 6.91 6.91 ChEMBL
CCK2 GASR Mouse Cholecystokinin A pKi 8.52 8.52 8.52 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
CCK2 GASR Dog Cholecystokinin A pIC50 7.4 7.4 7.4 ChEMBL