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Detalhes da Produção
| Tipo | Artigo Publicado |
| Grupo | Produção Bibliográfica |
| Descrição | de Paula, A.A.N. ; Martins, J.B.L. ; M.Santos, L.dos ; de C. Nascente, L. ; ROMEIRO, L. A. S. ; Areas, T.F.M.A. ; Vieira, K.S.T. ; Gamb^oa, N.F. ; Castro, N.G. ; Gargano, R.. New potential AChE inhibitor candidates. European Journal of Medicinal Chemistry, v. 44, p. 3754-3759, 2009. |
| Autor | Luiz Antonio Soares Romeiro |
| Ano | 2009 |
Informações Complementares
| Ano do artigo | 2009 |
| Descricão e Informacões Adicionais | We have theoretically studied new potential candidates of acetylcholinesterase (AChE) inhibitors designed from cardanol, a non-isoprenoid phenolic lipid of cashew Anacardium occidentale nut-shell liquid. The electronic structure calculations of _f-teen molecules derivatives from cardanol were performed using B3LYP level with 6-31 G, 6-31G(d), and 6-311 + G(2d,p) basis functions. For this study we used the fol-lowing groups: methyl, acetyl, N,N-dimethylcarbamoyl, N,N-dimethylamine, N,N-diethylamine, piperidine, pyrrolidine, and N,N-methylbenzylamine. Among the proposed compounds we identi_ed that the structures with substitution by N,N-dimethyl-carbamoyl, N,N-dimethylamine, and pyrrolidine groups were better correlated to rivastigmine, and represent possible AChE inhibitors against Alzheimer disease |
| Descricão e Informacões Adicionais(en) | We have theoretically studied new potential candidates of acetylcholinesterase (AChE) inhibitors designed from cardanol, a non-isoprenoid phenolic lipid of cashew Anacardium occidentale nut-shell liquid. The electronic structure calculations of _f-teen molecules derivatives from cardanol were performed using B3LYP level with 6-31 G, 6-31G(d), and 6-311 + G(2d,p) basis functions. For this study we used the fol-lowing groups: methyl, acetyl, N,N-dimethylcarbamoyl, N,N-dimethylamine, N,N-diethylamine, piperidine, pyrrolidine, and N,N-methylbenzylamine. Among the proposed compounds we identi_ed that the structures with substitution by N,N-dimethyl-carbamoyl, N,N-dimethylamine, and pyrrolidine groups were better correlated to rivastigmine, and represent possible AChE inhibitors against Alzheimer disease |
| Divulgacão Científica | NAO |
| DOI | 10.1016/j.ejmech.2009.03.045 |
| Idioma | Inglês |
| ISSN | 02235234 |
| Meio de Divulgação | IMPRESSO |
| Natureza | COMPLETO |
| Página Final | 3759 |
| Página Inicial | 3754 |
| Relevância | NAO |
| Título do Artigo | New potential AChE inhibitor candidates |
| Título do Artigo(en) | New potential AChE inhibitor candidates |
| Título do Períodico ou Revista | European Journal of Medicinal Chemistry |
| Volume | 44 |