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Design, synthesis, antiviral bioactivity and three-dimensional quantitative structure-activity relationship study of novel ferulic acid ester derivatives containing quinazoline moiety.

Zengxue WuJian ZhangJixiang ChenJianke PanLei ZhaoDengyue LiuAwei ZhangJin ChenDeyu HuBao-An Song
Published in: Pest management science (2017)
Some of the title compounds demonstrated good antiviral activities. Three-dimensional quantitative structure-activity relationship models revealed that the antiviral activities depend on steric and electrostatic properties. These results could provide significant structural insights for the design of highly active ferulic acid derivatives. © 2017 Society of Chemical Industry.
Keyphrases
  • structure activity relationship
  • molecular dynamics simulations
  • recombinant human