Ligand id: 8099

Name: AGK2

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 4
Hydrogen bond donors 1
Rotatable bonds 5
Topological polar surface area 78.92
Molecular weight 433.04
XLogP 5.57
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

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

Bioactivity Comments
AGK2 may be therapeutically beneficial in diseases caused (at least in part) by aggregation of misfolded proteins.
Selectivity at enzymes
Key to terms and symbols Click column headers to sort
Target Sp. Type Action Affinity Units Concentration range (M) Reference
sirtuin 2 Hs Inhibitor Inhibition 4.5 – 5.8 pIC50 - 2-3
pIC50 4.5 – 5.8 (IC50 3.5x10-5 – 1.56x10-6 M) [2-3]