International Journal of Pharma and Bio Sciences
 
 
    ISSN 0975-6299
www.ijpbs.net
RESEARCH ARTICLE
Int J Pharm Bio Sci Volume 7, Issue 3, 2016 (July-Sept), Pages:208 - 225
2D AND 3D QSAR USING MANUAL METHOD OF 6-BENZIMIDAZOLE DERIVATIVES, ZINC METALLOPEPTIDASE AS ACE INHIBITOR
AS ANTI-HYPERTENSIVE AGENTS
K.RAJAMATHI, M.KALIDASAN, C. N. HEMALATHA M.VIJEY AANANDHI
DOI:
[Download PDF]
Abstract:

Zinc metallopeptidase is a promising target for drug intervention and its inhibitors are useful in antihypertensive activity. QSAR (2D and 3D) studies were performed on a series of Benzimidazole derivatives using (VLifeMDS4.2). QSAR study performed on 35 analogues of which 26 were used in the training set and the rest 9 is considered for the test set. Multiple linear regression (MLR) methodology with stepwise (sw) forward- backward variable selection method was used for building the QSAR models. The results of the 2D-QSAR models were further compared with 3D-QSAR models generated by manual method. The statistical significant model (r2=0. 7782; F test=25. 735; q2=0. 5576; q2se=0. 6544; pred_r2=0. 5975; pred_r2 se=1. 0889) were developed using molecular design suite (VLifeMDS4. 2) these investigating the substitutional requirements for the favourable anti-hypertensive activity. 1FNO ligands are used for docking in auto dock software. These biological active docking compounds are used to treat hypertension.

Keywords: Benzimidazole derivatives, QSAR, Antihypertensive activity, 1FNO, VLifeMDS4. 2
Welcome to IJPBS,Pharmaceutics, Novel, drug, delivery, system, Nanotechnology, Pharmacology, Pharmacognosy
Pharmaceutical Fields
Welcome to IJPBS,Pharmaceutics, Novel, drug, delivery, system, Nanotechnology, Pharmacology, Pharmacognosy Pharmaceutics
Welcome to IJPBS,Pharmaceutics, Novel, drug, delivery, system, Nanotechnology, Pharmacology, Pharmacognosy Novel drug delivery system
Welcome to IJPBS,Pharmaceutics, Novel, drug, delivery, system, Nanotechnology, Pharmacology, Pharmacognosy Nanotechnology
Welcome to IJPBS,Pharmaceutics, Novel, drug, delivery, system, Nanotechnology, Pharmacology, Pharmacognosy Pharmacology
Welcome to IJPBS,Pharmaceutics, Novel, drug, delivery, system, Nanotechnology, Pharmacology, Pharmacognosy Pharmacognosy
© Copyright 2009-2015 IJPBS, India. All rights reserved. Specialized online journals by ubijournal. Website by Ubitech Solutions
         Home I Contact I Terms & Conditions