capivasertib

Ligand id: 7709

Name: capivasertib

Structure and Physico-chemical Properties

2D Structure
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Calculated Physico-chemical Properties
Hydrogen bond acceptors 7
Hydrogen bond donors 4
Rotatable bonds 7
Topological polar surface area 120.16
Molecular weight 428.17
XLogP 2.44
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Selectivity at enzymes
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Target Sp. Type Action Value Parameter Concentration range (M) Reference
AKT serine/threonine kinase 2 Hs Inhibitor Inhibition 8.1 pIC50 - 1
pIC50 8.1 (IC50 8x10-9 M) [1]
AKT serine/threonine kinase 3 Hs Inhibitor Inhibition 8.1 pIC50 - 1
pIC50 8.1 (IC50 8x10-9 M) [1]
AKT serine/threonine kinase 1 Hs Inhibitor Inhibition 7.6 – 8.5 pIC50 - 1-2
pIC50 8.5 (IC50 3x10-9 M) [1]
pIC50 7.6 (IC50 2.543x10-8 M) [2]