Green and efficient one-pot three-component synthesis of novel drug-like furo[2,3-d]pyrimidines as potential active site inhibitors and putative allosteric hotspots modulators of both SARS-CoV-2 M<sup>Pro</sup> and PL<sup>Pro</sup>.

Mousavi, Hossein; Zeynizadeh, Behzad; Rimaz, Mehdi

Green and efficient one-pot three-component synthesis of novel drug-like furo[2,3-d]pyrimidines as potential active site inhibitors and putative allosteric hotspots modulators of both SARS-CoV-2 M^Pro and PL^Pro.

Mousavi, Hossein; Zeynizadeh, Behzad; Rimaz, Mehdi.

Afiliação

Mousavi H; Department of Organic Chemistry, Faculty of Chemistry, Urmia University, Urmia, Iran. Electronic address: 1hossein.mousavi@gmail.com.
Zeynizadeh B; Department of Organic Chemistry, Faculty of Chemistry, Urmia University, Urmia, Iran.
Rimaz M; Department of Chemistry, Payame Noor University, P.O. Box 19395-3697, Tehran, Iran.

Bioorg Chem ; 135: 106390, 2023 06.

Article em En | MEDLINE | ID: mdl-37037129

Assuntos

COVID-19; SARS-CoV-2; Humanos; Antivirais/farmacologia; Catálise; Domínio Catalítico; Simulação de Acoplamento Molecular; Simulação de Dinâmica Molecular; Inibidores de Proteases/farmacologia; Pirimidinonas/química; Pirimidinonas/farmacologia

Palavras-chave

ADMET; COVID-19; Furo[2,3-d]pyrimidine; Green chemistry; Main protease (M(Pro)); Molecular docking; Multi-component reaction (MCR); Multi-targeting inhibitor; One-pot; Papain-like protease (PL(Pro)); SARS-CoV-2

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Texto completo: 1 Coleções: 01-internacional Base de dados: MEDLINE Assunto principal: SARS-CoV-2 / COVID-19 Limite: Humans Idioma: En Revista: Bioorg Chem Ano de publicação: 2023 Tipo de documento: Article

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