title: QSAR studies on 1,2-dithiole-3-thiones: modeling of lipophilicity, quinone reductase specific activity, and production of growth hormone.
abstract: Studies on modeling of lipophilicity (logP) quinone reductase specific activity (logCDQR) and production of growth hormone (logCDGH) of 1,2-dithiole-3-thiones have been carried out using distance-based topological indices. The regression analysis of the data has shown that the set of compounds exhibit 'familial' relationships in that excellent results are obtained by dividing the data set into two or more classes (families).
authors.affiliation: Research Division, Laxmi Fumigation and Pest Control (P) Ltd, 3 Khatipura, Indore 452 007, India. pvkhadikar@rediffmail.com
authors.forename: Padmakar
authors.initials: P
authors.lastname: Khadikar
authors.forename: Mona
authors.initials: M
authors.lastname: Jaiswal
authors.forename: Madhu
authors.initials: M
authors.lastname: Gupta
authors.forename: Dheeraj
authors.initials: D
authors.lastname: Mandloi
authors.forename: Raj Singh
authors.initials: RS
authors.lastname: Sisodia
mesh_terms: D000818:Animals; D013006:Growth Hormone / Q000096:biosynthesis; D006801:Humans; D057927:Hydrophobic and Hydrophilic Interactions; D008722:Methods; D008958:Models, Molecular; D016660:NAD(P)H Dehydrogenase (Quinone) / Q000378:metabolism; D021281:Quantitative Structure-Activity Relationship; D012044:Regression Analysis; D013871:Thiones / Q000737:chemistry* / Q000494:pharmacology
chemical_list: D013871:Thiones; D013006:Growth Hormone; D016660:NAD(P)H Dehydrogenase (Quinone)