INTERRELATION OF CARCINOGENIC PROPERTIES OF METABOLITES WITH THEIR INFORMATION AND ELECTRONIC DESCRIPTORS

Volume 3, Issue 1, February 2018     |     PP. 1-14      |     PDF (198 K)    |     Pub. Date: January 14, 2018
DOI:    414 Downloads     7182 Views  

Author(s)

VLADIMIR MUKHOMOROV, University of Naples “Federico II” Via Cintia, I-80126, Naples, ITALY

Abstract
The interrelationship between the carcinogenic effects of metabolites and molecular descriptors is modeled. The information function and the average number of valence electrons of molecules are used as molecular descriptors. It is demonstrated that the conversion of non-carcinogenic initial agents to carcinogenic metabolites is accompanied by a systematic increase in molecular descriptors. The factor that limits the carcinogenic activity of chemical compounds is considered.

Keywords
Carcinogen, metabolite, descriptors, oxy compounds, information, valence electrons

Cite this paper
VLADIMIR MUKHOMOROV, INTERRELATION OF CARCINOGENIC PROPERTIES OF METABOLITES WITH THEIR INFORMATION AND ELECTRONIC DESCRIPTORS , SCIREA Journal of Biology. Volume 3, Issue 1, February 2018 | PP. 1-14.

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