example 98 [WO2011020806]

Ligand id: 6540

Name: example 98 [WO2011020806]

Structure and Physico-chemical Properties

2D Structure
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Calculated Physico-chemical Properties
Hydrogen bond acceptors 6
Hydrogen bond donors 2
Rotatable bonds 4
Topological polar surface area 89.6
Molecular weight 376.11
XLogP 1.9
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

1. Andreini M, Banner D, Guba W, Hilpert H, Mauser H, Mayweg AV, Narquizian R, Power E, Rogers-Evans M, Travagli M et al.. (2011)
3-amino-5-phenyl-5,6-dihydro-2h-[1,4]oxazine derivatives.
Patent number: WO2011020806. Assignee: F. Hoffmann-La Roche Ag, Siena Biotech S.P.A. Priority date: 04/12/2014. Publication date: 04/12/2014.
2. Southan C. (2013)
BACE2 as a new diabetes target: a patent review (2010 - 2012).
Expert Opin Ther Pat, 23 (5): 649-63. [PMID:23506624]