SU9516

Ligand id: 6045

Name: SU9516

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 3
Hydrogen bond donors 2
Rotatable bonds 2
Topological polar surface area 67.01
Molecular weight 241.09
XLogP 0.97
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

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

Selectivity at enzymes
Key to terms and symbols Click column headers to sort
Target Sp. Type Action Value Parameter Concentration range (M) Reference
cyclin dependent kinase 5 Hs Inhibitor Inhibition 7.7 pIC50 - 3
pIC50 7.7 (IC50 2.2x10-8 M) [3]
Description: In vitro inhibition of CDK5/p25.
cyclin dependent kinase 2 Hs Inhibitor Inhibition 7.6 – 7.7 pIC50 - 3-4
pIC50 7.7 (IC50 2.2x10-8 M) [4]
Description: CDK2/cyclin A complex used in assay
pIC50 7.6 (IC50 2.6x10-8 M) [3]
Description: In vitro inhibition of CDK2/cyclin E.
pIC50 7.6 (IC50 2.7x10-8 M) [3]
Description: In vitro inhibition of CDK2/cyclin A.
cyclin dependent kinase 1 Hs Inhibitor Inhibition 6.8 – 7.4 pIC50 - 3-4
pIC50 7.4 (IC50 4x10-8 M) [4]
Description: CDK1/cyclin B complex used in assay
pIC50 6.8 (IC50 1.68x10-7 M) [3]
Description: In vitro inhibition of CDK1/cyclin B.
cyclin dependent kinase 4 Hs Inhibitor Inhibition 5.8 – 6.7 pIC50 - 3-4
pIC50 6.7 (IC50 2x10-7 M) [4]
Description: CDK4/cyclin D1 complex used in assay
pIC50 5.8 (IC50 1.7x10-6 M) [3]
Description: In vitro inhibition of CDK4/cyclin D.
cyclin dependent kinase 7 Hs Inhibitor Inhibition 6.0 pIC50 - 3
pIC50 6.0 (IC50 9.05x10-7 M) [3]
Description: In vitro inhibition of CDK7/cyclin H.
cyclin dependent kinase 9 Hs Inhibitor Inhibition 5.8 pIC50 - 3
pIC50 5.8 (IC50 1.5x10-6 M) [3]
Description: In vitro inhibition of CDK9/cyclin T.