高等学校化学学报

高等学校化学学报 ›› 1993, Vol. 14 ›› Issue (9): 1305.

• 研究简报 • 上一篇    下一篇

EHMO和模式识别法研究芬太尼衍生物的构效关系

陆文聪1, 阎立诚1, 朱友成2, 陈凯先2, 陈念贻3   

  1. 1. 上海科学技术大学化学系, 上海 201800;
    2. 中国科学院上海药物研究所;
    3. 中国科学院上海冶金研究所
  • 收稿日期:1992-12-15 修回日期:1993-03-01 出版日期:1993-09-24 发布日期:1993-09-24
  • 通讯作者: 陆文聪
  • 作者简介:第一作者:男, 29岁, 硕士, 讲师.

Studies on Structure-Activity Relationship of Fentanyl Derivatives by EHMO and Pattern Recognition Method

LU Wen-Cong1, YAN Li-Cheng1, ZHU You-Cheng2, CHEN Kai-Xian2, CHEN Nian-Yi3   

  1. 1. Department of Chemistry, Shanghai University of Science and Technology, Shanghai, 201800;
    2. Shanghai Institute of Materia Medica, Academia Sinica, Shanghai;
    3. Shanghai Institute of Metallurgy, Academia Sinica, Shanghai
  • Received:1992-12-15 Revised:1993-03-01 Online:1993-09-24 Published:1993-09-24

PDF (PC)

被引次数

11

关键词: ENMO, 模式识别, 芬太尼衍生物, 生物活性, 结构特征参数

Abstract: In this paper, the properties of the fentanyl derivatives were calculated by using EHMOmethod.Then, the correlation between the properties and biological activities of a series of fentanyl derivatives was calculated and analyzed by pattern recognition method.Two new compounds expected to possess higher biological activities have been designed on the basis of mathematical model.

Key words: EHMO, Pattern recognition, Fentanyl derivative, Biological activity, Characteristic parameter of stracture

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