Evaluation of Michael-type Acceptor Reactivity of 5-Benzylidenebarbiturates, 5-benzylidenerhodanines, and Related Heterocycles Using NMR

Despite existing experimental and computational tools to assess the risk, the non-specific chemical modification of protein thiol groups remains a significant source of false-positive hits, particularly in academic drug discovery. Herein, we describe the application of a simple NMR method in a syst...

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Detalhes bibliográficos

Principais autores:	Emilija Arsovska, Jurij Trontelj, Nace Zidar, Tihomir Tomašić, Lucija Peterlin Mašič, Danijel Kikelj, Janez Plavec, Anamarija Zega
Formato:	Artigo
Idioma:	Inglês
Publicado em:	Slovenian Chemical Society 2014-09-01
coleção:	Acta Chimica Slovenica
Assuntos:	Drug discovery False positives Michael acceptors 5-benzylidene heterocycles NMR spectroscopy
Acesso em linha:	https://acsi-journal.eu/index.php/ACSi/article/view/280
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