Atom level electrotopological state indexes in QSAR: designing and testing antithyroid agents

…, HA Al-Khamees, HS Abou-Auda, AP Simonelli

Index: Abou-Shaaban, Rafiq R. A.; Al-Khamees, Hamad A.; Abou-Auda, Hisham S.; Simonelli, Anthony P. Pharmaceutical Research, 1996 , vol. 13, # 1 p. 129 - 136

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Citation Number: 20

Abstract

Abstract Purpose. To design new antithyroid agents with less side effects, the electrotopological-state (E-state) indexes of thiourylene moiety (S N&S) was utilized as a guideline to develop five acyclic thio-urylene-type compounds with reduced antioxidant property. Methods. These agents were synthesized and screened for antithyroid activity in rats using 125 I-thiocyanate discharge technique. In addition, chemiluminescence studies ...