Chemical and Pharmaceutical Bulletin
Online ISSN : 1347-5223
Print ISSN : 0009-2363
ISSN-L : 0009-2363
NOVEL SUBSTITUENT ENTROPY CONSTANT σ REPRESENTS THE MOLECULAR CONNECTIVITY X AND IT RELATED INDICES
Yoshio SasakiTatsuya TakagiHideko KawakiAkihiro Iwata
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1983 Volume 31 Issue 1 Pages 330-332

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Abstract
The novel substituent entropy constant σ represents the molecular connectivity X, one of the QSAR descriptors developed by molecular topology. It is closely correlated with chromatographic retention data, such as retention time Rt or RT, and with retention index R.I. and specific retention volume Vg. Also, water solubility, boiling point and partition coefficient are represented by σ.
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© The Pharmaceutical Society of Japan
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