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Synthesis, Docking, and Anticoagulant Activity of New Factor-Xa Inhibitors in a Series of Pyrrolo[3,2,1-ij]Quinoline-1,2-Diones


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Abstract

New factor-Xa inhibitors in a series of pyrrolo[3,2,1-ij]quinoline-1,2-diones substituted by condensation at the β-carbonyl with rhodanine, arylamines, and H-tryptamines were synthesized, characterized, and studied by molecular docking. Promising factor-Xa inhibitors with inhibitory constants in the micromolar concentration range (IC50 = 0.7 – 40 μM) were discovered.

About the authors

S. M. Medvedeva

Voronezh State University

Author for correspondence.
Email: SMMedvedeva@rambler.ru
Russian Federation, 1 Universitetskaya Sq, Voronezh, 394006

A. Yu. Potapov

Voronezh State University

Email: SMMedvedeva@rambler.ru
Russian Federation, 1 Universitetskaya Sq, Voronezh, 394006

I. V. Gribkova

Federal Hematological Research Center, Ministry of Health of the Russian Federation

Email: SMMedvedeva@rambler.ru
Russian Federation, 4 Novyi Zykovskii Proezd, Moscow, 125167

E. V. Katkova

Research Computing Centre, M. V. Lomonosov Moscow State University

Email: SMMedvedeva@rambler.ru
Russian Federation, 1/4 Leninskie Gory, Moscow, 119991

V. B. Sulimov

Federal Hematological Research Center, Ministry of Health of the Russian Federation

Email: SMMedvedeva@rambler.ru
Russian Federation, 4 Novyi Zykovskii Proezd, Moscow, 125167

Kh. S. Shikhaliev

Research Computing Centre, M. V. Lomonosov Moscow State University

Email: SMMedvedeva@rambler.ru
Russian Federation, 1/4 Leninskie Gory, Moscow, 119991

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