abexinostat

Ligand id: 8366

Name: abexinostat

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 4
Hydrogen bond donors 3
Rotatable bonds 10
Topological polar surface area 104.04
Molecular weight 397.16
XLogP 2.33
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

References
1. Buggy JJ, Cao ZA, Bass KE, Verner E, Balasubramanian S, Liu L, Schultz BE, Young PR, Dalrymple SA. (2006)
CRA-024781: a novel synthetic inhibitor of histone deacetylase enzymes with antitumor activity in vitro and in vivo.
Mol. Cancer Ther.5 (5): 1309-17. [PMID:16731764]
2. Liu L, Chen B, Qin S, Li S, He X, Qiu S, Zhao W, Zhao H. (2010)
A novel histone deacetylase inhibitor Chidamide induces apoptosis of human colon cancer cells.
Biochem. Biophys. Res. Commun.392 (2): 190-5. [PMID:20060381]
3. Mithraprabhu S, Grigoriadis G, Khong T, Spencer A. (2010)
Deactylase inhibition in myeloproliferative neoplasms.
Invest New Drugs28 Suppl 1: S50-7. [PMID:21127942]
4. Prebet T, Vey N. (2011)
Vorinostat in acute myeloid leukemia and myelodysplastic syndromes.
Expert Opin Investig Drugs20 (2): 287-95. [PMID:21192773]