aloisine A

Ligand id: 5924

Name: aloisine A

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 4
Hydrogen bond donors 2
Rotatable bonds 3
Topological polar surface area 41.13
Molecular weight 267.14
XLogP 2.46
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
cyclin dependent kinase 2 Inhibitor Inhibition 6.9 pIC50 - 3
pIC50 6.9 (IC50 1.2x10-7 M) [3]
Description: CDK2 in association with cyclin A
cyclin dependent kinase 1 Inhibitor Inhibition 6.8 pIC50 - 3
pIC50 6.8 (IC50 1.5x10-7 M) [3]
Description: CDK1 in association with cyclin B
cyclin dependent kinase 5 Inhibitor Inhibition 6.8 pIC50 - 3
pIC50 6.8 (IC50 1.6x10-7 M) [3]
Description: CDK5 p35
glycogen synthase kinase 3 alpha Inhibitor Inhibition 6.3 pIC50 - 3
pIC50 6.3 (IC50 5x10-7 M) [3]