CHEMBL515268


SMILES CN1C(=O)[C@H](NC(=O)Nc2cccc(I)c2)N=C(c2ccccc2)c2ccccc21
InChIKey VLKJKVMACAESPP-NRFANRHFSA-N

Chemical properties

Hydrogen bond acceptors 3
Hydrogen bond donors 2
Rotatable bonds 3
Molecular weight (Da) 510.1

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 pKd 8.53 8.53 8.53 ChEMBL
CCK2 GASR Human Cholecystokinin A pKi 6.27 6.27 6.27 ChEMBL
CCK1 CCKAR Human Cholecystokinin A pKi 8.43 8.43 8.43 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
CCK1 CCKAR Rat Cholecystokinin A pIC50 6.1 6.1 6.1 ChEMBL
CCK2 GASR Human Cholecystokinin A pIC50 8.16 8.16 8.16 ChEMBL