Ligand id: 8473

Name: AZD5438

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 7
Hydrogen bond donors 1
Rotatable bonds 5
Topological polar surface area 98.15
Molecular weight 371.14
XLogP 2.78
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

1. Byth KF, Thomas A, Hughes G, Forder C, McGregor A, Geh C, Oakes S, Green C, Walker M, Newcombe N et al.. (2009)
AZD5438, a potent oral inhibitor of cyclin-dependent kinases 1, 2, and 9, leads to pharmacodynamic changes and potent antitumor effects in human tumor xenografts.
Mol. Cancer Ther., 8 (7): 1856-66. [PMID:19509270]
2. Malumbres M, Barbacid M. (2005)
Mammalian cyclin-dependent kinases.
Trends Biochem. Sci., 30 (11): 630-41. [PMID:16236519]
3. Ortega S, Malumbres M, Barbacid M. (2002)
Cyclin D-dependent kinases, INK4 inhibitors and cancer.
Biochim. Biophys. Acta, 1602 (1): 73-87. [PMID:11960696]
4. Santamaria D, Ortega S. (2006)
Cyclins and CDKS in development and cancer: lessons from genetically modified mice.
Front. Biosci., 11: 1164-88. [PMID:16146805]
5. Shapiro GI. (2006)
Cyclin-dependent kinase pathways as targets for cancer treatment.
J. Clin. Oncol., 24 (11): 1770-83. [PMID:16603719]