AZD3839

Ligand id: 6931

Name: AZD3839

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 5
Hydrogen bond donors 2
Rotatable bonds 4
Topological polar surface area 76.72
Molecular weight 433.15
XLogP 5.16
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

References
1. Jeppsson F, Eketjäll S, Janson J, Karlström S, Gustavsson S, Olsson LL, Radesäter AC, Ploeger B, Cebers G, Kolmodin K et al.. (2012)
Discovery of AZD3839, a potent and selective BACE1 inhibitor clinical candidate for the treatment of Alzheimer disease.
J. Biol. Chem.287 (49): 41245-57. [PMID:23048024]