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Issue 3, 2016
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Integrating multicomponent flow synthesis and computational approaches for the generation of a tetrahydroquinoline compound based library

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Abstract

The combination of flow chemistry and computational tools has been successfully applied to prepare a focused library of tricyclic tetrahydroquinolines endowed with drug-like properties. The study illustrates the efficient synthesis of this class of compounds using flow mesoreactors in a multicomponent fashion, as well as the profitable employment of computational chemistry for library diversity analysis. Early biological characterization of selected compounds of the library are also presented for the discovery of novel chemical probes to unravel estrogen receptor signaling pathways.

Graphical abstract: Integrating multicomponent flow synthesis and computational approaches for the generation of a tetrahydroquinoline compound based library

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Publication details

The article was received on 05 Oct 2015, accepted on 05 Nov 2015 and first published on 16 Nov 2015


Article type: Research Article
DOI: 10.1039/C5MD00455A
Author version available: Download Author version (PDF)
Citation: Med. Chem. Commun., 2016,7, 439-446
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    Integrating multicomponent flow synthesis and computational approaches for the generation of a tetrahydroquinoline compound based library

    B. Cerra, S. Mostarda, C. Custodi, A. Macchiarulo and A. Gioiello, Med. Chem. Commun., 2016, 7, 439
    DOI: 10.1039/C5MD00455A

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