On the topological evidences for modelling lipophilicity

被引：21

作者：

Agrawal, VK

Singh, J

Khadikar, PV

机构：

[1] Laxmi Fumigat & Pest Control Pvt Ltd, Div Res, Indore 452007, India

[2] APS Univ, QSAR, Rewa 486003, India

[3] APS Univ, Chem Labs, Rewa 486003, India

来源：

BIOORGANIC & MEDICINAL CHEMISTRY | 2002年 / 10卷 / 12期

关键词：

D O I：

10.1016/S0968-0896(02)00299-7

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：

Topological evidences for modelling lipophilicity of a large series of diversed compounds have been provided on the basis of distance-based topological indices. A pool of topological indices along with indicator parameters related to the type of the compounds present in the set of 140 compounds were used for this purpose, The results have shown that topology as well as the type of compounds are the responsible parameters for modelling lipophilicity. (C) 2002 Elsevier Science Ltd. All rights reserved.

引用

页码：3981 / 3996

页数：16

共 41 条

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