compound 30 [PMID: 22902653]

Ligand id: 8118

Name: compound 30 [PMID: 22902653]

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 8
Hydrogen bond donors 2
Rotatable bonds 10
Topological polar surface area 143.05
Molecular weight 503.21
XLogP 4.26
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
LIM domain kinase 2 Inhibitor Inhibition 7.8 pIC50 - 2
pIC50 7.8 (IC50 1.6x10-8 M) [2]
LIM domain kinase 1 Inhibitor Inhibition 7.6 pIC50 - 2
pIC50 7.6 (IC50 2.3x10-8 M) [2]
testis-specific kinase 2 Inhibitor Inhibition 6.4 pIC50 - 2
pIC50 6.4 (IC50 4.15x10-7 M) [2]
testis-specific kinase 1 Inhibitor Inhibition 5.9 pIC50 - 2
pIC50 5.9 (IC50 1.133x10-6 M) [2]