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Bioorg Med Chem
; 11(20): 4523-33, 2003 Oct 01.
Article
in English
| MEDLINE
| ID: mdl-13129588
ABSTRACT
This paper deals with a Quantitative Structure-Activity Relationship (QSAR) study on a large set of 123 compounds using a combination of topological indices as well as Abraham's molecular descriptors. The results have shown that an excellent model (R=0.9542) is obtained in hexa-parametric correlation containing W, logRB (topological indices) along with R2, sigmapi2H, sigmabeta2O and Vx as the correlating parameters. The results are discussed critically.