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Synthesis molecular modeling and anticonvulsant activity of some hydrazone, semicarbazone, and thiosemicarbazone derivatives of benzylidene camphor

机译:亚苄基樟脑的部分,、半卡巴和硫代半卡巴derivatives衍生物的合成分子模型和抗惊厥活性

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Abstract: Four series of 20 novel derivatives of benzylidene camphor with hydrazones, semicarbazones, and thiosemicarbazones were designed and synthesized. The newly synthesized compounds were evaluated for their anticonvulsant activity by maximal electroshock seizure model. Compounds showed varying degrees of anticonvulsant activity, most marked effect was observed for compounds 2f and 4d with lesser neurotoxicity. Molecular docking studies of most active compounds (2f and 4d) of the series revealed that they interact with LYS329A, GLN 301A, and THR 353B residues of 1OHV protein via hydrogen bonding and Pi interaction.
机译:摘要:设计合成了20种亚苄基樟脑与,半咔唑和硫代半咔唑的四种衍生物。通过最大电击癫痫发作模型评估新合成的化合物的抗惊厥活性。化合物显示出不同程度的抗惊厥活性,对于具有较小神经毒性的化合物2f和4d观察到最明显的作用。该系列中大多数活性化合物(2f和4d)的分子对接研究表明,它们通过氢键和Pi相互作用与1OHV蛋白的LYS329A,GLN 301A和THR 353B残基相互作用。

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