Topological approach to quantifying molecular lipophilicity of heterogeneous set of organic compounds

被引：29

作者：

Agrawal, VK

Bano, S

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, Comp Chem Labs, Rewa 486003, India

来源：

BIOORGANIC & MEDICINAL CHEMISTRY | 2003年 / 11卷 / 18期

关键词：

D O I：

10.1016/S0968-0896(03)00370-5

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 lipophilicity of the large set of organic compounds is investigated using distance-based topological indices. The results have shown that molecular lipophilicity can be modeled in multi-parametric model in that W, (1)chi, B, J and logRB along with indicator parameters are involved. The results are discussed critically. (C) 2003 Elsevier Ltd. All rights reserved.

引用

页码：4039 / 4047

页数：9

共 21 条

[1] On the topological evidences for modelling lipophilicity [J].