compound 38 [PMID: 20817473]

Ligand id: 8768

Name: compound 38 [PMID: 20817473]

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 9
Hydrogen bond donors 3
Rotatable bonds 10
Topological polar surface area 130.83
Molecular weight 544.23
XLogP 4.75
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
aurora kinase A Inhibitor Inhibition 7.7 pIC50 - 1
pIC50 7.7 (IC50 1.8x10-8 M) [1]
aurora kinase B Inhibitor Inhibition 7.3 pIC50 - 1
pIC50 7.3 (IC50 4.5x10-8 M) [1]
aurora kinase C Inhibitor Inhibition 7.2 pIC50 - 1
pIC50 7.2 (IC50 6.2x10-8 M) [1]
serine/threonine kinase 4 Inhibitor Inhibition 6.4 pIC50 - 1
pIC50 6.4 (IC50 4.12x10-7 M) [1]