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QSAR analysis of 1,4-dihydro-4-oxo-1-(2-thiazolyl)-1,8-naphthyridines with anticancer activity by Mariyana Atanasova; Sonia Ilieva; Boris Galabov is a Chemistry article available to read on EtoBox.
What is QSAR analysis of 1,4-dihydro-4-oxo-1-(2-thiazolyl)-1,8-naphthyridines with anticancer activity about?
In the present study a quantitative structure activity relationship (QSAR) analysis was applied to a series of 100 of 7-and 3-substituted 1,4dihydro-4-oxo-1-(2-thiazolyl)-1,8-naphthyridine derivatives. The Chem-X (version 2000) software was used to develop 3D QSAR models. The steric and electrostatic interactions between a probe atom (H þ ) and a set of aligned molecules were assessed using the comparative molecular field analysis method. Statistically relevant models were derived for both electrostatic and steric fields. A 2D model over a restricted series of close structural analogs was derived as well. A number of conclusions on the relationship between the type and size of different substituents and the antitumor activity of the compounds were derived.
Who reads QSAR analysis of 1,4-dihydro-4-oxo-1-(2-thiazolyl)-1,8-naphthyridines with anticancer activity?
It is typically read by researchers, students, and practitioners in Chemistry.
- Author
- Mariyana Atanasova; Sonia Ilieva; Boris Galabov
- Publisher
- Elsevier Science; Elsevier ; Elsevier BV (ISSN 0223-5234)
- Published
- 2007
- Language
- EN
- Field
- Chemistry (Physical Sciences)