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G-QSAR of Novel 2-{[2-(1H-imidazol-1-yl)ethyl]sulfanyl}-1H-benzimidazole Derivatives

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1TitleTitle of DocumentG-QSAR of Novel 2-{[2-(1H-imidazol-1-yl)ethyl]sulfanyl}-1H-benzimidazole Derivatives
2CreatorAuthor's name, affiliation, country MAYURA KALE, GAJANAN SONWANE and RAJESH NAWALE
Department of Pharmaceutical Chemistry, Government College of Pharmacy, Osmanpura, Aurangabad, Maharashtra, India
3SubjectDicipline(s) Chemical Science
3SubjectKeywords GQSAR, Benzimidazole, Antiprotozoal activity, Model generation
4DescriptionAbstract In the present work, we have applied group quantitative structure–activity relationships (G-QSAR) for exploring the relationship between the structures of a new emerging family of 2-{[2-(1H-imidazol-1-yl)ethyl]sulfanyl}-1H-benzimidazole derivatives and their antiprotozoal activities. We have developed descriptive models, in order to aid in further optimization and development of newer antiprotozoal agents containing the benzimidazole pharmacophore. G-QSAR was performed on VLife molecular design suite (MDS) 4.5 version software. The predictive power of the QSAR was checked through the cross validation technique and also by leaving some compounds as part of external test set
5PublishersOrganizing agency, location WWW Publications, India
6Contributor Sponsor(s) -
7DateDate (YYYY-MM-DD) -
8TypeStatus & genre Peer-reviewed Article
8TypeType
9FormateFile Formate PDF
10IdentifierUniform Resource Identifier Click Here
10IdentifierDigital Object Identifier
11SourceJournal/conference title; vol., no. (Year)Chemical Science Transactions, Volume  3 , Number  (2), (2014)
12LanuguageEnglish=en en
13RelationSupp.files
14Coverage -
15CopyrightCopyright and permissions
Chemical Science Transactions | Chem Sci Trans | CST | Online Chemistry Journal | Open Access
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