&#945;-Aminophosphonates 4-XC6H4-NH-CH(4-BrC6H4)-P(O)(OiPr)2 (X = H, Br, MeO): Crystal structures, Hirshfeld surface analysis, computational studies and in silico molecular docking with the SARS-CoV-2 proteins.

Alkhimova, Larisa E; Babashkina, Maria G; Safin, Damir A

α-Aminophosphonates 4-XC₆H₄-NH-CH(4-BrC₆H₄)-P(O)(OiPr)₂ (X = H, Br, MeO): Crystal structures, Hirshfeld surface analysis, computational studies and in silico molecular docking with the SARS-CoV-2 proteins.

Alkhimova, Larisa E; Babashkina, Maria G; Safin, Damir A.

Afiliação

Alkhimova LE; University of Tyumen, Volodarskogo Str. 6, 625003, Tyumen, Russian Federation.
Babashkina MG; Institute of Condensed Matter and Nanosciences, Université Catholique de Louvain, Place L. Pasteur 1, 1348, Louvain-la-Neuve, Belgium.
Safin DA; University of Tyumen, Volodarskogo Str. 6, 625003, Tyumen, Russian Federation.

Tetrahedron ; 97: 132376, 2021 Sep 24.

Article em En | MEDLINE | ID: mdl-34366492

Palavras-chave

Aminophosphonate; Computational studies; Crystal structure; DFT; Hirshfeld surface analysis; Molecular docking

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Texto completo: 1 Coleções: 01-internacional Base de dados: MEDLINE Idioma: En Revista: Tetrahedron Ano de publicação: 2021 Tipo de documento: Article País de publicação: Reino Unido

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