QSAR STUDIES, AND IN SILICO ADME PREDICTION OF P-AMINOSALICYLIC ACID DERIVATIVES AS NEURAMINIDASE INHIBITORS

  • Mithilesh Kumar Dwivedi Department of Chemistry,Holkar Science College,Indore,(M.P.),INDIA
  • Purushottam Das Soni
  • Shailja Sachan
  • Santosh Tiwari

Abstract

QSAR analysis on a set of  synthesized p-Aminosalysilic Acid derivatives analogues tested growth inhibitory antiviral activity was performed by using MLR procedure. The activity contribution of these compounds were determined from regression equation and the validation procedures to analyze the predictive ability of QSAR models were described.The results are discussed on the basis of statistical data. High agreement between experimental  and predicted antiviral activity inhibitory values are obtained. The results revealed the significant roles of topological, geometrical and substituent electronic descriptor parameters on the inhibitory activitypIc50 of coumarin derivative analogues of the studied molecules

Key Words: QSAR, Antiviral Activity, MLR

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Author Biography

Mithilesh Kumar Dwivedi, Department of Chemistry,Holkar Science College,Indore,(M.P.),INDIA

Department of Chemistry,Holkar Science College,Indore,(M.P.),INDIA

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1.
Dwivedi M, Soni P, Sachan S, Tiwari S. QSAR STUDIES, AND IN SILICO ADME PREDICTION OF P-AMINOSALICYLIC ACID DERIVATIVES AS NEURAMINIDASE INHIBITORS. JDDT [Internet]. 15May2015 [cited 29Sep.2020];5(3):80-6. Available from: http://www.jddtonline.info/index.php/jddt/article/view/1151