Reaction Details | |||
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Target | Replicase polyprotein 1ab | ||
Ligand | BDBM581884 | ||
Substrate/Competitor | n/a | ||
Meas. Tech. | Rapid-Fire MS Biochemical Assay measuring Mpro activity (5nM Mpro) | ||
IC50 | <20±n/a nM | ||
Citation | ![]() | ||
More Info.: | Get all data from this article, Assay Method | ||
Replicase polyprotein 1ab | |||
Name: | Replicase polyprotein 1ab | ||
Synonyms: | ORF1ab polyprotein | R1AB_SARS2 | pp1ab | rep | ||
Type: | Protein | ||
Mol. Mass.: | 794070.71 | ||
Organism: | 2019-nCoV | ||
Description: | P0DTD1 | ||
Residue: | 7096 | ||
Sequence: |
| ||
BDBM581884 | |||
n/a | |||
Name | BDBM581884 | ||
Synonyms: | WO2022224223, Example 16 | WO2022224223, Example 16a | WO2022224223, Example 16b | ||
Type | Small organic molecule | ||
Emp. Form. | C21H13F3N4O2 | ||
Mol. Mass. | 410.3487 | ||
SMILES | FC(F)(F)c1ccc2n(CCC#N)c(=O)n(-c3cncc4ccccc34)c(=O)c2c1 |(-7.63,-.02,;-6.29,-.79,;-6.29,-2.33,;-4.96,-1.56,;-4.96,-.02,;-4.96,1.52,;-3.62,2.29,;-2.29,1.52,;-.96,2.29,;-.96,3.83,;-2.29,4.6,;-2.29,6.14,;-2.29,7.68,;.38,1.52,;1.71,2.29,;.38,-.02,;1.71,-.79,;1.71,-2.33,;3.04,-3.1,;4.38,-2.33,;4.38,-.79,;5.71,-.02,;5.71,1.52,;4.38,2.29,;3.04,1.52,;3.04,-.02,;-.96,-.79,;-.96,-2.33,;-2.29,-.02,;-3.62,-.79,)| | ||
Structure | ![]() |