The newer antiviral molecule is the need at the current situation because of drug resistance in antiviral treatment. First generation Nonnucleoside reverse transcriptase inhibitors (NNRTI) are playing a crucial role in the treatment of HIV infection. Pharmacophore modeling of designed compound is a predictive tool to have higher success rate in drug discovery. In this article series of isatin derivative were designed and pharmacophore modeling was performed. Designed molecules were docked with the crystal structure of proteins and passed through ADME (absorption, distribution, metabolism and excretion) screening.
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