compound J [PMID: 21907142]

Ligand id: 7854

Name: compound J [PMID: 21907142]

Structure and Physico-chemical Properties

2D Structure
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Calculated Physico-chemical Properties
Hydrogen bond acceptors 5
Hydrogen bond donors 2
Rotatable bonds 4
Topological polar surface area 105.67
Molecular weight 378.07
XLogP 3
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

1. Beauchamp J et al. (2011)
2 -aminodihydro [1, 3] thiazines as BACE2 inhibitors for the treatment of diabetes.
Patent number: WO2011029803. Assignee: Roche. Priority date: 31/10/2014. Publication date: 17/03/2011.
2. Esterházy D, Stützer I, Wang H, Rechsteiner MP, Beauchamp J, Döbeli H, Hilpert H, Matile H, Prummer M, Schmidt A et al.. (2011)
Bace2 is a β cell-enriched protease that regulates pancreatic β cell function and mass.
Cell Metab., 14 (3): 365-77. [PMID:21907142]