CCT244747

Ligand id: 8215

Name: CCT244747

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 8
Hydrogen bond donors 1
Rotatable bonds 8
Topological polar surface area 114.01
Molecular weight 408.2
XLogP 0.33
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

View interactive charts of activity data from ChEMBL and GtoPdb across species (New!)

Bioactivity Comments
In a selectivity profile screen of 140 kinases (at 1μM) CCT244747 inhibited only 8 by >70% (excluding CHK1 which was inhibited by 83% in this screen). These were RSK1 and -2, AMPK, IRAK1, NUAK1, BRSK1 and -2 and TrkA [1].
Selectivity at human enzymes
Key to terms and symbols Click column headers to sort
Target Type Action Affinity Units Concentration range (M) Reference
checkpoint kinase 1 Inhibitor Inhibition 8.1 pIC50 - 1
pIC50 8.1 (IC50 7.7x10-9 M) [1]
BR serine/threonine kinase 1 Inhibitor Inhibition - - - 1
[1]
Description: Measured as % inhibition using 1μM compound.
BR serine/threonine kinase 2 Inhibitor Inhibition - - - 1
[1]
Description: Measured as % inhibition using 1μM compound.