Ligand id: 7341

Name: ataluren

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 3
Hydrogen bond donors 1
Rotatable bonds 3
Topological polar surface area 76.22
Molecular weight 284.06
XLogP 4.49
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

1. Ainsworth C. (2005)
Nonsense mutations: running the red light.
Nature, 438 (7069): 726-8. [PMID:16340982]
2. Hoffman EP, Connor EM. (2013)
Orphan drug development in muscular dystrophy: update on two large clinical trials of dystrophin rescue therapies.
Discovery medicine., 16 (89): 33-9. [PMID:24229740]
3. McElroy SP, Nomura T, Torrie LS, Warbrick E, Gartner U, Wood G, McLean WH. (2013)
A lack of premature termination codon read-through efficacy of PTC124 (Ataluren) in a diverse array of reporter assays.
PLoS biology, 11 (6): e1001593. [PMID:23824517]
4. Welch EM, Barton ER, Zhuo J, Tomizawa Y, Friesen WJ, Trifillis P, Paushkin S, Patel M, Trotta CR, Hwang S et al. (2007)
PTC124 targets genetic disorders caused by nonsense mutations.
Nature, 447 (7140): 87-91. [PMID:17450125]