AZD1981

Ligand id: 7680

Name: AZD1981

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 5
Hydrogen bond donors 2
Rotatable bonds 6
Topological polar surface area 96.63
Molecular weight 388.06
XLogP 3.92
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

References
1. Cook D, Brown D, Alexander R, March R, Morgan P, Satterthwaite G, Pangalos MN. (2014)
Lessons learned from the fate of AstraZeneca's drug pipeline: a five-dimensional framework.
Nat Rev Drug Discov13 (6): 419-31. [PMID:24833294]
2. Luker T, Bonnert R, Brough S, Cook AR, Dickinson MR, Dougall I, Logan C, Mohammed RT, Paine S, Sanganee HJ et al.. (2011)
Substituted indole-1-acetic acids as potent and selective CRTh2 antagonists-discovery of AZD1981.
Bioorg. Med. Chem. Lett.21 (21): 6288-92. [PMID:21944852]