理論および計算科学ジャーナル
オープンアクセス

概要

Structural Elucidation of Drug Aspirin by Using Various Software Tools Like HyperChem, Argus Lab, ChemSketch, Avogrado and Chemeo Database

Laxmi K*

Aspirin (Acetyl Salicyclic Acid) is known for its use as antipyretic, analgesic and anti-inflammatory drug, in this
paper, a computational study of Aspirin is carried out using various software tools like, Hyperchem, Argus lab,
Chemsketch, Avagrado and Chemeo database. QSAR Properties and Molecular properties of Aspirin obtained by
using Hyperchem 7.5 software. The electronic properties and Electrostatic Potential (ESP) of the compound Aspirin
were obtained by using Argus lab software. Molecular Properties and 3D optimized forms of Aspirin were obtained by
using Chemsketch software. Avogadro version 1.1 is used to interpret theoretically the structural properties of Aspirin
in detail and using this software the molecule properties and standard representations of Aspirin were obtained. By,
using Chemeo database the Chemical and Physical Properties of Aspirin were determined.