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QSAR study of antiplatelet agents.

Abstract：

:A QSAR methodology that involves multilinear (Hansch-type) and nonlinear (ANN backpropagation) approaches was developed to correlate the antiplatelet activity of 60 benzoxazinone derivatives against factor Xa. The statistical characteristics provided by multilinear model (R2 = 0.821) indicated satisfactory stability and predictive ability, while the ANN predictive ability is somewhat superior (R2 = 0.909). The multilinear model provided insight into the main factors that modulate the inhibitory activity of the investigated compounds.

journal_name

Bioorg Med Chem

journal_title

Bioorganic & medicinal chemistry

authors

Katritzky AR,Pacureanu LM,Slavov S,Dobchev DA,Karelson M

doi

10.1016/j.bmc.2006.07.022

subject

Has Abstract

pub_date

2006-11-15 00:00:00

pages

7490-500

issue

22

eissn

0968-0896

issn

1464-3391

pii

S0968-0896(06)00578-5

journal_volume

14

pub_type

杂志文章

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