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The Investigation of Structure-Activity Relationships of Tacrine Analogues: Electronic-Topological Method

机译:他克林类似物的构效关系研究:电子拓扑方法

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In this study we investigated the structure-activity relationships by using the Electron- Topological Method (ETM) for a class of AChE inhibitors related to tacrine (9-amino-1,2,3,4-tetrahydroacridine) and 11 H-Indeno-[1,2-b]-quinolin-10-ylamine that tetracyclic tacrine analogues, a drug currently in use for the treatment of the AD. Molecular fragments being specific for active and inactive compounds were revealed by using ETM. The result of testing showed the high ability of ETM in predicting the activity and inactivity in investigated series.
机译:在这项研究中,我们使用电子拓扑学方法(ETM)研究了与他克林(9-氨基-1,2,3,4-四氢ac啶)和11 H-茚满-甲基相关的一类AChE抑制剂的构效关系。 [1,2-b]-喹啉-10-基胺四环他克林类似物,目前用于治疗AD的药物。通过使用ETM揭示了对活性和非活性化合物具有特异性的分子片段。测试结果表明,ETM在预测所研究系列的活性和非活性方面具有很高的能力。

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