Ligand id: 873

Name: CI-988

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 10
Hydrogen bond donors 5
Rotatable bonds 16
Topological polar surface area 149.62
Molecular weight 614.31
XLogP 6.13
No. Lipinski's rules broken 2

Molecular properties generated using the CDK

View interactive charts of activity data from GtoPdb and ChEMBL (where available) across species

Selectivity at GPCRs
Key to terms and symbols Click column headers to sort
Target Sp. Type Action Affinity Units Concentration range (M) Reference
CCK2 receptor Hs Antagonist Antagonist 9.1 pIC50 - 1
pIC50 9.1 [1]
CCK2 receptor Mm Antagonist Antagonist 8.8 pIC50 - 2
pIC50 8.8 [2]
CCK1 receptor Rn Antagonist Antagonist 5.6 pIC50 - 2
pIC50 5.6 [2]