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Mendeleev Communications, 2016, Volume 26, Issue 3, Pages 212–213
DOI: https://doi.org/10.1016/j.mencom.2016.04.011
(Mi mendc2162)
 

This article is cited in 10 scientific papers (total in 10 papers)

Communications

Computer modeling of ferrocene-substituted 3,7-diazabicyclo[3.3.1]nonanes as serine protease inhibitors

S. Z. Vatsadzea, D. A. Shulgaa, Yu. D. Loginovaa, I. A. Vatsadzeb, L. Wangc, H. Yuc, K. V. Kudryavtseva

a Department of Chemistry, M.V. Lomonosov Moscow State University, Moscow, Russian Federation
b N.D. Zelinsky Institute of Organic Chemistry, Russian Academy of Sciences, Moscow, Russian Federation
c Department of Chemistry, Zhejiang University, Hangzhou, China
Abstract: The docking study of ferrocene-substituted bispidines to binding sites of thrombin and factor Xa has shown that bispidine scaffold provides a 3D-arranegment of all substituents and a direction for the ferrocene group to fill the S4 pocket for both thrombin and factor Xa.
Bibliographic databases:
Document Type: Article
Language: English
Supplementary materials:
Supplementary_data_1.pdf (653.8 Kb)


Citation: S. Z. Vatsadze, D. A. Shulga, Yu. D. Loginova, I. A. Vatsadze, L. Wang, H. Yu, K. V. Kudryavtsev, “Computer modeling of ferrocene-substituted 3,7-diazabicyclo[3.3.1]nonanes as serine protease inhibitors”, Mendeleev Commun., 26:3 (2016), 212–213
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  • https://www.mathnet.ru/eng/mendc/v26/i3/p212
  • This publication is cited in the following 10 articles:
    Citing articles in Google Scholar: Russian citations, English citations
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