对接(动物)
抗真菌
三唑
化学
广谱
烷基
立体化学
组合化学
药理学
药品
活动站点
计算生物学
生物
生物化学
医学
酶
有机化学
微生物学
护理部
作者
Nan Wang,Xin‐Sheng Chai,Ying Chen,Lei Zhang,Wenjuan Li,Yijun Gao,Yi Bi,Shichong Yu,Qingguo Meng
出处
期刊:Medicinal Chemistry
日期:2013-02-01
被引量:9
标识
DOI:10.2174/1573406411309030009
摘要
In order to meet the urgent need for novel antifungal agents with improved activity and broader spectrum, a series of 3/4-[[N-alkyl-2-(2,4-difluorophenyl)-2-hydroxy-3-(1H-1, 2, 4-triazole)] propylamino] benzylethyl carbonate were designed, synthesized and evaluated as antifungal agents. The MIC80 values indicate that all the compounds showed only moderate or even no antifungal activities against nearly all the tested fungal pathogens. Moreover, the interactions of the most active compounds in the drug binding site of CACYP51 were also explored with the help of docking studies.
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