Abstract
A novel 5-alky-6-(cyclohexylmethyl)-2-((2-hydroxy-2-phenylethyl)thio)-pyrimidin-4(3H)-one derivatives were synthesized and their ability to inhibit HIV evaluated . The screening results revealed that compounds 2a-g had a favorable property in inhibiting HIV. The compounds 2b, in particular, showed a special potent anti-HIV activities with EC50 values of 0.003μM and CC50 values of 200 μM. Preliminary structure-activity relationship (SAR) and molecular modeling analyses of these newly synthesized hydroxylphenethyl-S-DACOs are also discussed.
Keywords: Anti HIV-1 activity; Water-solubility; Molecular Docking; NNRTIs; Pyrimidone; S-DACOs.
Letters in Drug Design & Discovery
Title:Synthesis and Biological Evaluation of Novel Hydroxylphenethyl-SDACOs as High Active Anti-HIV Agents
Volume: 10 Issue: 3
Author(s): Dao-Chun Wu, Dao-Ming Zhuang, Xiao-Feng Liu, Li-He Lu, Hua Wang, Cong Li, Christopher Cong Lai, Jing-Yun Li and Yan-Ping He
Affiliation:
Keywords: Anti HIV-1 activity; Water-solubility; Molecular Docking; NNRTIs; Pyrimidone; S-DACOs.
Abstract: A novel 5-alky-6-(cyclohexylmethyl)-2-((2-hydroxy-2-phenylethyl)thio)-pyrimidin-4(3H)-one derivatives were synthesized and their ability to inhibit HIV evaluated . The screening results revealed that compounds 2a-g had a favorable property in inhibiting HIV. The compounds 2b, in particular, showed a special potent anti-HIV activities with EC50 values of 0.003μM and CC50 values of 200 μM. Preliminary structure-activity relationship (SAR) and molecular modeling analyses of these newly synthesized hydroxylphenethyl-S-DACOs are also discussed.
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Cite this article as:
Wu Dao-Chun, Zhuang Dao-Ming, Liu Xiao-Feng, Lu Li-He, Wang Hua, Li Cong, Cong Lai Christopher, Li Jing-Yun and He Yan-Ping, Synthesis and Biological Evaluation of Novel Hydroxylphenethyl-SDACOs as High Active Anti-HIV Agents, Letters in Drug Design & Discovery 2013; 10 (3) . https://dx.doi.org/10.2174/1570180811310030011
DOI https://dx.doi.org/10.2174/1570180811310030011 |
Print ISSN 1570-1808 |
Publisher Name Bentham Science Publisher |
Online ISSN 1875-628X |
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