L-365260


SMILES Cc1cccc(c1)NC(=O)NC1N=C(c2ccccc2)c2c(N(C1=O)C)cccc2
InChIKey KDFQABSFVYLGPM-UHFFFAOYSA-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
D1 DRD1 Human Dopamine A pKi 5.52 5.52 5.52 ChEMBL
5-HT2B 5HT2B Human 5-Hydroxytryptamine A pKi 5.21 5.21 5.21 ChEMBL
5-HT2A 5HT2A Human 5-Hydroxytryptamine A pKi 5.67 5.67 5.67 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
CCK2 GASR Human Cholecystokinin A pIC50 8.4 8.4 8.4 Guide to Pharmacology
CCK1 CCKAR Rat Cholecystokinin A pIC50 6.6 6.6 6.6 Guide to Pharmacology
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 6.82 7.97 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 6.8 8.52 ChEMBL
CCK2 GASR Human Cholecystokinin A pIC50 6.55 8.1 8.96 ChEMBL
CCK1 CCKAR Human Cholecystokinin A pIC50 6.8 6.8 6.8 ChEMBL