Computer-Aided Design of Anticancer 1,4-Naphthoquinone Derivatives
Lubna H. M. Ali, Ahmed E. M. Saeed
Chemical Science International Journal · pp. 1–11 · Published 12 Apr 2017
10.9734/CSJI/2017/31344Abstract
Aims: Evaluation the impact of p-naphthoquinones upon biological activities and extent based upon QSAR technique. Study Design: QSAR Approach. Methodology: About twelve - eleven naphthoquinones which have cytotoxic effect against eight cancer cell lines: L1210, P388, NCI-H358M, OVCAR-8, PC-3M DU145, T24 and MCF7 and partition coefficient descriptor was used to find good QSAR model. Results: The biological activity and partition coefficient of naphthoquinones can be modeled with linear regression with negative coefficient and good satisfied statistical data for all these cancer cell lines Conclusion: The inhibition of eight cancer cell lines is influenced mainly by partition coefficient.
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