Identifying opportunities for late-stage C-H alkylation with high-throughput experimentation and in silico reaction screening
Abstract Enhancing the properties of advanced drug candidates is aided by the direct incorporation of specific chemical groups, avoiding the need to construct the entire compound from the ground up. Nevertheless, their chemical intricacy often poses challenges in predicting reactivity for C-H activa...
Main Authors: | David F. Nippa, Kenneth Atz, Alex T. Müller, Jens Wolfard, Clemens Isert, Martin Binder, Oliver Scheidegger, David B. Konrad, Uwe Grether, Rainer E. Martin, Gisbert Schneider |
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Format: | Article |
Language: | English |
Published: |
Nature Portfolio
2023-11-01
|
Series: | Communications Chemistry |
Online Access: | https://doi.org/10.1038/s42004-023-01047-5 |
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