L-365260


SMILES Cc1cccc(NC(=O)N[C@@H]2N=C(c3ccccc3)c3ccccc3N(C)C2=O)c1
InChIKey KDFQABSFVYLGPM-QFIPXVFZSA-N

Chemical properties

Hydrogen bond acceptors 3
Hydrogen bond donors 2
Rotatable bonds 3
Molecular weight (Da) 398.2

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 6.57 7.53 7.92 ChEMBL
CCK2 GASR Rat Cholecystokinin A pKd 7.54 7.54 7.54 ChEMBL
CCK2 GASR Mouse Cholecystokinin A pKi 8.4 8.41 8.43 ChEMBL
CCK1 CCKAR Guinea pig Cholecystokinin A pKi 6.33 6.42 6.5 ChEMBL
CCK1 CCKAR Rat Cholecystokinin A pKi 9.83 9.83 9.83 ChEMBL
CCK2 GASR Human Cholecystokinin A pKi 7.75 8.39 8.8 ChEMBL
CCK1 CCKAR Human Cholecystokinin A pKi 6.76 6.76 6.76 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
CCK1 CCKAR Mouse Cholecystokinin A pIC50 4.96 4.96 4.96 ChEMBL
CCK2 GASR Rat Cholecystokinin A pIC50 7.41 7.41 7.41 ChEMBL
CCK2 GASR Mouse Cholecystokinin A pIC50 7.54 8.1 8.7 ChEMBL
CCK1 CCKAR Guinea pig Cholecystokinin A pIC50 7.07 7.48 8.7 ChEMBL
CCK1 CCKAR Rat Cholecystokinin A pIC50 6.13 6.38 6.64 ChEMBL
CCK2 GASR Human Cholecystokinin A pIC50 7.54 8.36 8.96 ChEMBL
CCK1 CCKAR Human Cholecystokinin A pIC50 6.8 6.8 6.8 ChEMBL