Ligand id: 8697

Name: trifluridine

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 7
Hydrogen bond donors 3
Rotatable bonds 3
Topological polar surface area 99.1
Molecular weight 296.06
XLogP -0.07
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

1. Tanaka N, Sakamoto K, Okabe H, Fujioka A, Yamamura K, Nakagawa F, Nagase H, Yokogawa T, Oguchi K, Ishida K et al.. (2014)
Repeated oral dosing of TAS-102 confers high trifluridine incorporation into DNA and sustained antitumor activity in mouse models.
Oncol. Rep., 32 (6): 2319-26. [PMID:25230742]
2. Temmink OH, de Bruin M, Comijn EM, Fukushima M, Peters GJ. (2005)
Determinants of trifluorothymidine sensitivity and metabolism in colon and lung cancer cells.
Anticancer Drugs, 16 (3): 285-92. [PMID:15711180]