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2018-10-30

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Si us plau utilitzeu sempre aquest identificador per citar o enllaçar aquest document: https://hdl.handle.net/2445/162874

Combined Virtual/Experimental Multicomponent Solid Forms Screening of Sildenafil: New Salts, Cocrystals, and Hybrid Salt−Cocrystals

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Recurs relacionat

https://doi.org/10.1021/acs.cgd.8b01413

Resum

New multicomponent solid forms of sildenafil have been discovered by means of a combined virtual/experimental cocrystal screening. Coformer selection of candidates was conducted based on an in silico screening method from a database of more than 2000 organic compounds, and the intensive experimental screen produced 23 new solid forms. Since the 12 coformers chosen have a combination of phenol and carboxylic acid groups, a variety of cocrystals, salts, and hybrid salt-cocrystals were discovered and characterized.

Matèries

Àcids orgànics, Sals, Estructura cristal·lina (Sòlids)

Matèries (anglès)

Organic acids, Salts, Layer structure (Solids)

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Articles publicats en revistes (Mineralogia, Petrologia i Geologia Aplicada)

Citació

BARBAS CAÑERO, Rafael, et al. Combined Virtual/Experimental Multicomponent Solid Forms Screening of Sildenafil: New Salts, Cocrystals, and Hybrid Salt−Cocrystals. Crystal Growth & Design. 2018. Vol. 18, num. 12, pags. 7618-7627. ISSN 1528-7483. [consulted: 20 of June of 2026]. Available at: https://hdl.handle.net/2445/162874

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