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Slight difference in the isomeric oximes K206 and K203 makes huge difference for the reactivation of organophosphorus-inhibited AChE: Theoretical and experimental aspects

The result's identifiers

  • Result code in IS VaVaI

    <a href="https://www.isvavai.cz/riv?ss=detail&h=RIV%2F62690094%3A18470%2F19%3A50015739" target="_blank" >RIV/62690094:18470/19:50015739 - isvavai.cz</a>

  • Alternative codes found

    RIV/00179906:_____/19:10397171

  • Result on the web

    <a href="https://www.sciencedirect.com/science/article/pii/S0009279719302959?via%3Dihub" target="_blank" >https://www.sciencedirect.com/science/article/pii/S0009279719302959?via%3Dihub</a>

  • DOI - Digital Object Identifier

    <a href="http://dx.doi.org/10.1016/j.cbi.2019.05.037" target="_blank" >10.1016/j.cbi.2019.05.037</a>

Alternative languages

  • Result language

    angličtina

  • Original language name

    Slight difference in the isomeric oximes K206 and K203 makes huge difference for the reactivation of organophosphorus-inhibited AChE: Theoretical and experimental aspects

  • Original language description

    Studies with oximes have been extensively developed to design new reactivators with better efficiency, and greater spectrum of action. In this study, we aimed to analyze the influence of the Carbamoyl group position change in two isomeric oximes, K203 and K206, on the reactivation percentage of Mus musculus Acetylcholinesterase (MmAChE), inhibited by different nerve agents. Theoretical calculations were performed to assess the difference for the oxime activity with inhibited AChE-complexes and the factors that govern this difference. Comparing theoretical and experimental data, it is possible to observe that this change between the oximes results in different reactivation percentage for the same nerve agent, due to the different interaction modes and activation energy for the studied systems.

  • Czech name

  • Czech description

Classification

  • Type

    J<sub>imp</sub> - Article in a specialist periodical, which is included in the Web of Science database

  • CEP classification

  • OECD FORD branch

    30108 - Toxicology

Result continuities

  • Project

    <a href="/en/project/NV16-34390A" target="_blank" >NV16-34390A: Development of new environment friendly insecticides against malaria mosquito</a><br>

  • Continuities

    I - Institucionalni podpora na dlouhodoby koncepcni rozvoj vyzkumne organizace

Others

  • Publication year

    2019

  • Confidentiality

    S - Úplné a pravdivé údaje o projektu nepodléhají ochraně podle zvláštních právních předpisů

Data specific for result type

  • Name of the periodical

    Chemico-biological interactions

  • ISSN

    0009-2797

  • e-ISSN

  • Volume of the periodical

    309

  • Issue of the periodical within the volume

    August

  • Country of publishing house

    IE - IRELAND

  • Number of pages

    7

  • Pages from-to

    "Article Number: 108671"

  • UT code for WoS article

    000482178500001

  • EID of the result in the Scopus database

    2-s2.0-85067563170