Novel estimation of lipophilic behaviour of polychlorinated biphenyls

Bioorg Med Chem Lett. 2002 Apr 8;12(7):1125-8. doi: 10.1016/s0960-894x(02)00086-0.

Abstract

A novel method has been developed for the estimation of lipophilic behaviour of polychlorinated biphenyls (PCBs) using the recently introduced Padmakar-Ivan (PI) index. The results obtained are compared with the earlier reported Abraham method. The statistical analyses showed that the proposed method based on the PI index is quite useful.

MeSH terms

  • Chemical Phenomena
  • Chemistry, Physical
  • Chlorine / chemistry
  • Lipids / chemistry*
  • Models, Chemical
  • Molecular Structure
  • Polychlorinated Biphenyls / analysis*
  • Polychlorinated Biphenyls / chemistry*
  • Quantitative Structure-Activity Relationship
  • Regression Analysis

Substances

  • Lipids
  • Chlorine
  • Polychlorinated Biphenyls