Enabling Efficient Late-Stage Functionalization of Drug-Like Molecules with LC-MS and Reaction-Driven Data Processing-Reference-Cited by-同舟云学术

Enabling Efficient Late-Stage Functionalization of Drug-Like Molecules with LC-MS and Reaction-Driven Data Processing

Published:2017-12-20 Issue:47 Volume:2017 Page:7122-7126
ISSN:1434-193X
Container-title:European Journal of Organic Chemistry
language:en
Short-container-title:Eur. J. Org. Chem.

Author:

Yao Huifang¹,Liu Yong²,Tyagarajan Sriram³,Streckfuss Eric³,Reibarkh Mikhail²,Chen Kuanchang³,Zamora Ismael⁴,Fontaine Fabien⁴,Goracci Laura⁵,Helmy Roy²,Bateman Kevin P.¹,Krska Shane W.³^ORCID

Affiliation:

1. Department of Pharmacokinetics; Pharmacodynamics and Drug Metabolism; Merck Sharp & Dohme Corp.; Kenilworth NJ USA

2. Department of Process Research & Development; Merck Sharp & Dohme Corp.; Rahway NJ USA

3. HTE & Lead Discovery Capabilities; Merck Sharp & Dohme Corp.; Kenilworth NJ USA

4. Lead Molecular Design, S.L.; Sant Cugat Del Valles Spain

5. Department of Chemistry, Biology and Biotechnology; University of Perugia; Perugia Italy

Funder

European Regional Development Fund

Agència per la competitivitat de l'empresa

Publisher

Wiley

Subject

Organic Chemistry,Physical and Theoretical Chemistry

Link

http://onlinelibrary.wiley.com/wol1/doi/10.1002/ejoc.201701573/fullpdf

Reference43 articles.

1. The medicinal chemist's toolbox for late stage functionalization of drug-like molecules

2. IsoScore: automated localization of biotransformations by mass spectrometry using product ion scoring of virtual regioisomers

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4. Enhanced metabolite identification with MSE and a semi-automated software for structural elucidation

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