[Analysis of acute toxicity (LD50-value) or organic chemicals to mammals by solubility parameter (delta) (2). Acute oral toxicity to mice].

H Nishimura, S Saito, F Kishida, M Matsuo
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引用次数: 1

Abstract

Acute oral toxicity (LD50-value) of organic chemicals to mice was analyzed by using solubility parameter (delta c), a thermodynamic parameter, of the chemicals. As it was observed in the previous study with rats, parabolic correlations were established between logarithm of LD50-value (mmol/kg body weight, mice) and delta c of all the collected chemicals (n = 85, R = 0.626), alcohols (n = 10, R = 0.683), ketones (n = 7, R = 0.631) and aromatics (n = 62, R = 0.645). Introducing molar volume (Vc) to the above equations did not improve the correlations. Although statistically significant correlations were not found in alcohols and ketones with mice, we successfully assured the theoretical equation regardless of species difference by establishing significant correlations with all the collected chemicals and aromatics. By analysis, we could determine the solubility parameter of 2.27 x 10(4) (J/m3)1/2 for the biological membrane (absorption site) of mice. As the delta c-values which dip the LD50-values are approximately the same for mice and rats, common deleterious effects and mechanism may be working at common target sites. In addition, no species difference in sensitivity (toxicity) was found for the aromatics. For comparison, log P was used to describe LD50 of all the collected chemicals, but no correlation was established (R = 0.004-0.418).

[通过溶解度参数(δ)分析有机化学品对哺乳动物的急性毒性(ld50值)(2).对小鼠的急性口服毒性]。
用化学物质的热力学参数溶解度参数(δ c)分析了有机化学物质对小鼠的急性口服毒性(ld50值)。与之前对大鼠的研究一样,所有收集到的化学物质(n = 85, R = 0.626)、醇类(n = 10, R = 0.683)、酮类(n = 7, R = 0.631)和芳香族(n = 62, R = 0.645)的ld50值(mmol/kg体重,小鼠)的对数与δ c呈抛物线相关。在上述方程中引入摩尔体积(Vc)并没有改善相关性。虽然在统计上没有发现醇类和酮类与小鼠的显著相关性,但我们通过建立与所有收集到的化学物质和芳烃的显著相关性,成功地确保了不考虑物种差异的理论方程。通过分析,我们可以确定小鼠生物膜(吸收部位)的溶解度参数为2.27 × 10(4) (J/m3)1/2。由于使ld50值下降的δ c值在小鼠和大鼠中大致相同,因此可能在共同的靶点发生共同的有害作用和机制。此外,对芳香化合物的敏感性(毒性)没有发现物种差异。为了比较,所有收集到的化学物质的LD50都用log P表示,但没有建立相关关系(R = 0.004-0.418)。
本文章由计算机程序翻译,如有差异,请以英文原文为准。
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