Comparative QSAR in toxicology: examples from teratology and cancer chemotherapy of aniline mustards.

Abstract:

:During the past 30 years, thousands of quantitative structure-activity relationships (QSAR) have been published for all sorts of chemicals acting on many forms of life or parts thereof (DNA, enzymes, organelles, etc.). Very little effort has been made to show the relationship among these equations. In this report, we discuss two examples, the toxicity of phenols to rats and the effect of aniline mustards on a variety of living systems, where the electronic effects in the QSAR can be correlated to QSAR from physical organic chemistry. This enables one to make better mechanistic deductions about the biological structure-activity relationships. From this, it is concluded that radicals formed from the phenols cause birth defects.

journal_name

Crit Rev Toxicol

authors

Hansch C,Telzer BR,Zhang L

doi

10.3109/10408449509089887

subject

Has Abstract

pub_date

1995-01-01 00:00:00

pages

67-89

issue

1

eissn

1040-8444

issn

1547-6898

journal_volume

25

pub_type

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