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Comparative QSAR: Radical Toxicity and Scavenging. Two Different Sides of the Same Coin

 

作者: C. Hansch,   L. Zhang,  

 

期刊: SAR and QSAR in Environmental Research  (Taylor Available online 1995)
卷期: Volume 4, issue 2-3  

页码: 73-82

 

ISSN:1062-936X

 

年代: 1995

 

DOI:10.1080/10629369508029905

 

出版商: Taylor & Francis Group

 

关键词: QSAR of radical toxicity;QSAR of radical scavengers;QSAR of oxidoreductases

 

数据来源: Taylor

 

摘要:

From an analysis of the toxicity of phenols to rat embryos and anilines to embryo fibroblast cells a new type of toxicity is postulated for these classes of compounds. Substituents which increase the electron density on the aromatic ring as estimated by σ+or εHOMOincrease potency. It is postulated that it is the radical form of the phenols and the anilines that accounts for their toxicity. The results are compared with QSAR for radical scavengers and oxidoreductases acting on phenols, anilines and carbazoles.

 

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