Synthesis and comparative molecular field analysis (CoMFA) of antitumor 3-arylisoquinoline derivatives

被引：27

作者：

Cho, WJ ^{[1
]}

Kim, EK

Park, MJ

Choi, SU

Lee, CO

Cheon, SH

Choi, BG

Chung, BH

机构：

[1] Chonnam Natl Univ, Coll Pharm, Kwangju 500757, South Korea

[2] Korea Res Inst Chem Technol, Daejeon, South Korea

来源：

BIOORGANIC & MEDICINAL CHEMISTRY | 1998年 / 6卷 / 12期

关键词：

antitumor agents; 3-arylisoquinolines; benzo[C]phenanthridine; CoMFA;

D O I：

10.1016/S0968-0896(98)80019-9

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：

In this study a series of 3-arylisoquinoline derivatives were synthesized and cytotoxicity against human melanoma tumor cell evaluated, and a three dimensional quantitative structure-activity relationship was investigated using the comparative molecular field analysis (CoMFA). The results suggested that the electrostatic, steric and hydrophobic factors of 3-arylisoquinolines were strongly correlated with the antitumor activity. Considerable predictive ability (cross-validated r(2) as high as 0.721) was obtained through CoMFA, (C) 1998 Elsevier Science Ltd. All rights reserved.

引用

页码：2449 / 2458

页数：10

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