lintitript


SMILES OC(=O)Cn1c(cc2c1cccc2)C(=O)Nc1scc(n1)c1ccccc1Cl
InChIKey ILNRQFBVVQUOLP-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 5
Hydrogen bond donors 2
Rotatable bonds 5
Molecular weight (Da) 411.0

Drug properties

Molecular type Small molecule
Physiological/Surrogate Surrogate
Approved drug Yes

Bioactivities

Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
CCK2 GASR Rat Cholecystokinin A pKi 9.24 9.24 9.24 PDSP Ki database
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
CCK1 CCKAR Human Cholecystokinin A pIC50 9.25 9.25 9.25 ChEMBL
CCK1 CCKAR Human Cholecystokinin A pIC50 8.3 8.3 8.3 Guide to Pharmacology
CCK1 CCKAR Rat Cholecystokinin A pIC50 9.7 9.7 9.7 Guide to Pharmacology