Correlations between topological resonance energy of methyl-substituted benz[c]acridines, benzo[a]phenothiazines and chrysenes, and their carcinogenic or antitumor activities

Anticancer Res. 1996 Sep-Oct;16(5A):2757-65.

Abstract

In order to clarify the effects of methyl substitution on the carcinogenic activity, each resonance energy (RE) of benz[c]acridines, benzo[a]phenothiazines, chrysene, and their methyl derivatives was calculated by Aihara's TRE theory. Some correlations seem to exist between the values of resonance energy per pi-electron for the cationic species-with the lack of the atom having the highest approximate superdelocalizability (Sr'(E)) from their parents skeleton-and carcinogenic activity.

MeSH terms

  • Acridines / chemistry*
  • Acridines / pharmacology
  • Anticarcinogenic Agents / chemistry*
  • Anticarcinogenic Agents / pharmacology*
  • Carcinogens / chemistry*
  • Carcinogens / toxicity*
  • Chrysenes / chemistry*
  • Chrysenes / toxicity*
  • Phenothiazines / chemistry*
  • Phenothiazines / pharmacology
  • Structure-Activity Relationship

Substances

  • Acridines
  • Anticarcinogenic Agents
  • Carcinogens
  • Chrysenes
  • Phenothiazines
  • benz(c)acridine
  • phenothiazine