6.
A Quantitative Structural Activity Relationship Study to Predict
Antimycobacterial Effect of Some 2-Alkyl Sulphanyl Derivatives of
Benzimidazole
Sandeep Kr.Gupta1*, Rajkumar Agrawal2,
S.S.Pancholi1
1. S.K.Patel College of Pharmaceutical Education & Research, Kherva,
Mehsana, Gujarat,
2 . J.K. Institute of Pharmacy, Bilaspur, Chattis Garh
E-mail:
sandeep_pharma@rediffmail.com
Abstract.
A
Quantitative Structural Activity Relationship study was
performed on a series of 2-alkyl sulphanyl benzimidazoles that
have previously been tested for their antimycobacterial activity
against Mycobacterium tuberculosis and some non-tuberculous
mycobacterium. Several statistical expressions were developed
using stepwise multiple linear regression analysis. The best
models were further validated by leave-one-out method and most
acceptable QSAR model for prediction of antimycobacterial
activity of the investigated series of benzimidazole was
developed. The results of this study suggests that spatial
parameters like low bulkiness and presence of electron
withdrawing group plays a significant role in explaining
antimycobacterial activity of the synthesized compounds. Thus
the study simplifies design of new active molecules.
KEYWORDS:
QSAR; benzimidazole derivatives; multiple
linear regressions.
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