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Synthesis, docking, machine learning and antiproliferative activity of the 6-ferrocene/heterocycle-2-aminopyrimidine and 5-ferrocene-1H-Pyrazole derivatives obtained by microwave-assisted Atwal reaction as potential anticancer agents.
Filho, Eclair Venturini; Pina, Jorge W S; Antoniazi, Mariana K; Loureiro, Laiza B; Ribeiro, Marcos A; Pinheiro, Carlos B; Guimarães, Celina J; de Oliveira, Fátima C E; Pessoa, Claudia; Taranto, Alex G; Greco, Sandro J.
Afiliación
  • Filho EV; Chemistry Department, Federal University of Espírito Santo, Vitória, Espírito Santo CEP.:29075-910, Brazil.
  • Pina JWS; Chemistry Department, Federal University of Espírito Santo, Vitória, Espírito Santo CEP.:29075-910, Brazil.
  • Antoniazi MK; Chemistry Department, Federal University of Espírito Santo, Vitória, Espírito Santo CEP.:29075-910, Brazil.
  • Loureiro LB; Chemistry Department, Federal University of Espírito Santo, Vitória, Espírito Santo CEP.:29075-910, Brazil.
  • Ribeiro MA; Chemistry Department, Federal University of Espírito Santo, Vitória, Espírito Santo CEP.:29075-910, Brazil.
  • Pinheiro CB; Physical Department, Minas Gerais Federal University, Av. Antônio Carlos 6627, Pampulha, Belo Horizonte, Minas Gerais CEP.: 30161-970 Brazil.
  • Guimarães CJ; Department of Physiology and Pharmacology, Faculty of Medicine, Federal University of Ceará., Fortaleza, Ceará CEP 60430-275, Brazil; Pharmacy Sector, Foundation of Oncology Control of the State of Amazonas, Manaus, Amazonas, CEP 69040-010, Brazil.
  • de Oliveira FCE; Department of Physiology and Pharmacology, Faculty of Medicine, Federal University of Ceará., Fortaleza, Ceará CEP 60430-275, Brazil.
  • Pessoa C; Department of Physiology and Pharmacology, Faculty of Medicine, Federal University of Ceará., Fortaleza, Ceará CEP 60430-275, Brazil.
  • Taranto AG; Laboratory of Drug Design and Bioinformatics, Federal University of São João del-Rei, São João del-Rei, Minas Gerais CEP: 36307-352, Brazil.
  • Greco SJ; Chemistry Department, Federal University of Espírito Santo, Vitória, Espírito Santo CEP.:29075-910, Brazil. Electronic address: sandro.greco@ufes.br.
Bioorg Med Chem Lett ; 48: 128240, 2021 09 15.
Article en En | MEDLINE | ID: mdl-34217828
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Texto completo: 1 Bases de datos: MEDLINE Asunto principal: Pirazoles / Pirimidinas / Compuestos Ferrosos / Simulación del Acoplamiento Molecular / Aprendizaje Automático / Metalocenos / Microondas / Antineoplásicos Límite: Humans Idioma: En Revista: Bioorg Med Chem Lett Asunto de la revista: BIOQUIMICA / QUIMICA Año: 2021 Tipo del documento: Article País de afiliación: Brasil
Texto completo
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Texto completo: 1 Bases de datos: MEDLINE Asunto principal: Pirazoles / Pirimidinas / Compuestos Ferrosos / Simulación del Acoplamiento Molecular / Aprendizaje Automático / Metalocenos / Microondas / Antineoplásicos Límite: Humans Idioma: En Revista: Bioorg Med Chem Lett Asunto de la revista: BIOQUIMICA / QUIMICA Año: 2021 Tipo del documento: Article País de afiliación: Brasil