4.7 Article

Comparison of QSPR models of octanol/water partition coefficient for vitamins and non vitamins

期刊

EUROPEAN JOURNAL OF MEDICINAL CHEMISTRY
卷 41, 期 11, 页码 1271-1278

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ELSEVIER FRANCE-EDITIONS SCIENTIFIQUES MEDICALES ELSEVIER
DOI: 10.1016/j.ejmech.2006.06.006

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QSPR; octanol/water partition coefficient; vitamins; graph of atomic orbitals (GAO)

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Comparison of QSPR models for vitamins and for various substances, which are not vitamins indicates that vitamins have less number of molecular features (topologic and kinds of atomic orbitals), but, most probably, more complex mechanisms of interactions with molecules of water and octanol. (c) 2006 Elsevier Masson SAS. All rights reserved.

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