Prediction of the Bioconcentration Facto
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Vishnu Kumar Sahu; Rajesh Kumar Singh
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Article
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2009
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John Wiley and Sons
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English
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Quantitative structure-activity relationship (QSAR) models for bioconcentration factor (BCF) prediction applicable to 131 organic compounds of different chemical structures were prepared. The study showed that the best QSAR model, p BCF = 0.00250227 M W -0.0723952 E T -0.21352 eHOMO -0.892481 eLUMO