Molecular descriptors of N-arylhydroxamic acids:: A tool in drug design

被引:9
|
作者
Tiwari, Vaishali [1 ]
Pande, Rama [1 ]
机构
[1] Pt Ravishankar Shukla Univ, Raipur 492010, Chhattisgarh, India
关键词
drug design; hydrogen bond; hydroxamic acids; log P; molecular descriptors; steric descriptor;
D O I
10.1111/j.1747-0285.2006.00433.x
中图分类号
Q5 [生物化学]; Q7 [分子生物学];
学科分类号
071010 ; 081704 ;
摘要
The partition coefficient in the 1-octanol/water system, log P(O/W), is a measure of lipophilicity. It is used as a predictor of solute-membrane partitioning. The objective of this study was to measure the log P(O/W) of five hydroxamic acids. Other molecular descriptors of these solutes, namely molar volume, molar refraction, parachor, polarizability (pi*), hydrogen-bond donor acidity (epsilon alpha) and hydrogen-bond acceptor basicity (epsilon beta), have also been discussed. These properties represent the combined effects of a number of intermolecular forces between a solute and its environment.
引用
收藏
页码:225 / 228
页数:4
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