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Design, synthesis, antifungal activity and molecular docking of ring-opened pimprinine derivative containing (thio)amide structure.

Lan ChengJing-Rui LiuJia-Mu LiuDale GuoFang DengQiang BianHaifeng ZhangXinya HanAbdallah S AliWei-Hua ZhangMing-Zhi ZhangYu-Cheng Gu
Published in: Pest management science (2023)
The designed and optimized derivative 3o of ring-opening pimprinine has good antifungal activity and can be used as a new antifungal drug for further research. © 2023 Society of Chemical Industry.
Keyphrases
  • molecular docking
  • molecular dynamics simulations
  • candida albicans
  • water soluble
  • drug induced