Výsledky vyhledávání - "V. R. Khairullina"

Determination of the chain termination rate constants of the radical chain oxidation of organic compounds on antioxidant molecules by the QSPR method

Autor: Akhat G. Mustafin, A. Ya. Gerchikov, R. N. Nasretdinova, D. S. Mitsukova, Yu. Z. Martynova, V. R. Khairullina, G. G. Garifullina

Publikováno v: Russian Chemical Bulletin. 69:1679-1691

A quantitative analysis of the structure-antioxidant activity relationship was performed for 128 derivatives of phenols, amines, uracil, benzopyrane, and benzofuran using the GUSAR 2013 program. Nine statistically significant QSAR consensus models ch

Externí odkaz: https://explore.openaire.eu/search/publication?articleId=doi_________::d7f01fc708230aa1d84da4cea5ee8e4e
https://doi.org/10.1007/s11172-020-2948-7

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Green synthesis of new sulfanyl derivatives of ampyrone and prediction of their anti-inflammatory activity

Autor: Nail S. Akhmadiev, Vnira R. Akhmetova, V. R. Khairullina, Askhat G. Ibragimov, Ekaterina S. Mescheryakova

Publikováno v: Chemistry of Heterocyclic Compounds. 56:473-481

A selective method was developed for the synthesis of acyclic sulfanyl derivatives of ampyrone by thiomethylation reaction of 4-amino-2,3-dimethyl-1-phenyl-3-pyrazolin-5-one with formaldehyde and thiols in aqueous medium under various conditions (roo

Externí odkaz: https://explore.openaire.eu/search/publication?articleId=doi_________::27de4cc606a666a61cfac0a5d5e2c474
https://doi.org/10.1007/s10593-020-02683-8

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Quantitative structure-property relationship modeling of the C60 fullerene derivatives as electron acceptors of polymer solar cells: Elucidating the functional groups critical for device performance

Autor: Yulya N. Biglova, Yuliya Z. Martynova, Akhat G. Mustafin, V. R. Khairullina

Publikováno v: Journal of Molecular Graphics and Modelling. 88:49-61

Using the GUSAR 2013 program, we have performed a quantitative analysis of the "structure-power conversion efficiency (PCE)" on the series of 100 methano[60]fullerenes previously tested as acceptor components of bulk-heterojunction polymer organic so

Externí odkaz: https://explore.openaire.eu/search/publication?articleId=doi_________::ea49cd6e092c4487efc59f3adcdd1386
https://doi.org/10.1016/j.jmgm.2018.12.013

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QSAR-modeling of desoxyuridine triphosphatase inhibitors in a series of some derivatives of uracil

Autor: Akhat G. Mustafin, V. R. Khairullina, Yu. Z. Martynova, A. R. Gimadieva

Publikováno v: Biomeditsinskaya Khimiya. 65:103-113

Due to the widespread prevalence, deoxyuridine triphosphatase (UTPase) is considered by modern biochemists and physicians as a promising target for the development of drugs with a wide range of activities. The therapeutic effect of these drugs will b

Externí odkaz: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::9a4fe46520b3a2a709595cd746c47b43
https://doi.org/10.18097/pbmc20196502103

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Quantitative structure–activity relationship of the thymidylate synthase inhibitors of Mus musculus in the series of quinazolin-4-one and quinazolin-4-imine derivatives

Autor: Felix S. Zarudii, A. R. Gimadieva, Akhat G. Mustafin, V. R. Khairullina, Anatoly Ya. Gerchikov

Publikováno v: Journal of Molecular Graphics and Modelling. 85:198-211

A quantitative structure–activity relationship analysis of the 2-methylquinazolin-4-one and quinazolin-4-imine derivatives, well-known antifolate thymidylate synthase (TYMS) inhibitors, has been performed in the range IC50 = 0.4÷380000.0 nmoL/L us

Externí odkaz: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::edc026ceb21cd6f9fda29b38c68e1d9c
https://doi.org/10.1016/j.jmgm.2018.09.002

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QSAR Modelling of Thymidylate Synthase Inhibitors in a Series of Quinazoline Derivatives

Autor: F. S. Zarudii, V. R. Khairullina, A. Ya. Gerchikov, Alexey Lagunin

Publikováno v: Pharmaceutical Chemistry Journal. 51:884-888

Thymidylate synthase (ThS) is a target for antimetabolite antitumor drugs. Such drugs have been used in the clinic although they cause several severe side effects and accumulate in tissues. Therefore, new less toxic ThS inhibitors must be sought and

Externí odkaz: https://explore.openaire.eu/search/publication?articleId=doi_________::e4db830d973b0e011b1e751aad2e2c51
https://doi.org/10.1007/s11094-018-1710-z

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QSAR Assessing the Efficiency of Antioxidants in the Termination of Radical-Chain Oxidation Processes of Organic Compounds

Autor: Yuliya Z. Martynova, I. V. Safarova, V. R. Khairullina, Anatoly Ya. Gerchikov, G. M. Sharipova

Publikováno v: Molecules, Vol 26, Iss 421, p 421 (2021)
Molecules
Volume 26
Issue 2

Using the GUSAR 2013 program, the quantitative structure–antioxidant activity relationship has been studied for 74 phenols, aminophenols, aromatic amines and uracils having lgk7 = 0.01–6.65 (where k7 is the rate constant for the reaction of antio

Externí odkaz: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::8266bc48d9fe8e359d7428ba7b0337a5
https://doi.org/10.3390/molecules26020421

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Search for Nootropic Substances Based on Molecular Docking of Methanepyrido[1,2-a][1, 5]Diazocin[(-)-Cytisine] Derivatives to the Active Center of the Nicotinic Acetylcholine Receptor

Autor: F. S. Zarudii, A. Ya. Gerchikov, Inna P. Tsypysheva, V. R. Khairullina, M. N. Vasil’ev

Publikováno v: Pharmaceutical Chemistry Journal. 49:582-586

Docking of a series of methanepyrido[1,2-a][1,5]diazocin[(-)-cytisine derivatives to the active center of the nicotinic acetylcholine receptor was used to generate a set of potential substances for the treatment of cognitive dysfunction. The results

Externí odkaz: https://explore.openaire.eu/search/publication?articleId=doi_________::a1bdbd266081ad38f39b3da8b6f928e8
https://doi.org/10.1007/s11094-015-1333-6

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