BDBM496853 SARS-CoV-2 PLpro Inhibitor, 83

SMILES C[C@@H](NC(=O)c1cc(NC2CNC2)ccc1C)c1cccc(c1)-c1ccc(CN2CCC2)s1

InChI Key InChIKey=ULOJFGGJNMENAJ-LJQANCHMSA-N

Data  1 IC50  1 Kd

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 496853   

TargetReplicase polyprotein 1ab(2019-nCoV)
University Of Illinois At Chicago

LigandPNGBDBM496853(SARS-CoV-2 PLpro Inhibitor, 83)
Affinity DataKd:  1.79E+3nMAssay Description:The His-tagged SARS-CoV-2 PLpro enzyme was initially prepared in phosphate buffer and diluted to 50 ug/mL with 10 mM sodium acetate (pH 5.5) and immo...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails ArticlePubMed
TargetReplicase polyprotein 1ab(2019-nCoV)
University Of Illinois At Chicago

LigandPNGBDBM496853(SARS-CoV-2 PLpro Inhibitor, 83)
Affinity DataIC50:  2.20E+3nMAssay Description:The PLpro primary assay, which measures protease activity with the short peptide substrate Z-RLRGG-AMC (Bachem), was performed in black flat-bottom 3...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails ArticlePubMed