19.
Quantitative structure activity relationship using MLR method for
nitrobenzenes toxicity to tetrahymena pyriformis
Renu Kumaria, Rajneesh Kumara, Sushil Kumara,
Amitaa, Madhu Guptaa*
aChemistry
Department MMH PG College, Ghaziabad, India, e-mail:
madhuexe@gmail.com
Abstract:
The toxicity data of 42 nitroaromatic compounds
related to 50% growth inhibitory concentration (log IGC-150)
were used to develop Quantitative structure toxicity
relationship to tetrahymena pyriformis.The multiple linear
regression method was applied to select the descriptors.The six
parametric model were found to be the best which gives a
variance of more than 92% (R2=0.9248). Our results
have shown that six parameteric model containing second order
connectivity, a physicochemical parameter, distance based
Balaban and Balaban type of indices along with indicator
parameter play a dominating role in modeling toxicity (log IGC-150)
. The predictive powers of the models were also discussed by
using the method of cross-validation. Our results are
comparatively better than the result obtained by E.Estrada and
and E.Uriarte.
KEYWORDS: tetrahymena pyriformis, Biological
activity, indicator parameter, physicochemical parameters,
topological parameters, log IGC-150 growth
inhibitory concentration, which causes the death of 50% (one
half) of a group of test animal.
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