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StructuralGenomicsConsortium / CNP12-Nsp15-TAMU

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https://docs.google.com/spreadsheets/d/1V8cX5bVjVRNazExtO6E8YCDZtm8nlSFoL-nHTYfqbeE/edit#gid=480688714
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SRARS-COV-2 Nsp15 RA-0010874 2nd Hit expansion #7

Open qxsml opened 6 months ago

qxsml commented 6 months ago

After testing the 21 compounds and analyzing the results, please find the summary below. image image

A new series of compounds has been planned based on these results and is currently being synthesized for a second expansion. Please see below: image

rahmanszsaleem commented 6 months ago

Excellent work. Looking at the commonalities between the two compounds image

I am tempted to suggest that we should also prepare/purchase and test the following as derivatives of RA-0010874

image

X= H, COOH, OH Further, we may also substitute the heterocycle attached to quinoline with other N-heterocycles (depending on the commercial availability).

qxsml commented 6 months ago

Excellent work. Looking at the commonalities between the two compounds image

I am tempted to suggest that we should also prepare/purchase and test the following as derivatives of RA-0010874

image

X= H, COOH, OH Further, we may also substitute the heterocycle attached to quinoline with other N-heterocycles (depending on the commercial availability).

Hi Rahman, thank you very much for your suggestion, X=H form is totally doable, SMs are cheap. I'm keen to try conditions in this paper https://doi.org/10.1039/C9OB00033J, very interesting. I'll leave the OH version for the 3rd expansion if the H version gave promising results.

rahmanszsaleem commented 6 months ago

Yes, a wonderful synthetic protocol for the suggested molecules!