A-196

Ligand id: 8949

Name: A-196

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 4
Hydrogen bond donors 1
Rotatable bonds 3
Topological polar surface area 50.7
Molecular weight 358.08
XLogP 4.23
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!)

Selectivity at human enzymes
Key to terms and symbols Click column headers to sort
Target Type Action Affinity Units Concentration range (M) Reference
lysine methyltransferase 5B Inhibitor Inhibition 7.6 pIC50 - 1
pIC50 7.6 (IC50 2.5x10-8 M) [1]
Description: In vitro activity.
lysine methyltransferase 5C Inhibitor Inhibition 6.8 pIC50 - 1
pIC50 6.8 (IC50 1.44x10-7 M) [1]
Description: In vitro activity.