BDBM484213 Inhibitor 21 of SARS-CoV-2 Mpro

SMILES Cn1cc(-c2cc(-c3cc(Cl)c(F)c(OCc4scnc4C(F)(F)F)c3)c(=O)n(c2)-c2cccnc2)c(=O)[nH]c1=O

InChI Key InChIKey=PSJYNUWUIAUJEZ-UHFFFAOYSA-N

Data  1 IC50  1 EC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 484213   

TargetReplicase polyprotein 1ab(2019-nCoV)
Yale University

LigandPNGBDBM484213(Inhibitor 21 of SARS-CoV-2 Mpro)
Affinity DataEC50:  1.08E+3nMAssay Description:These include a rapid screening replicon assay using baby hamster kidney (BHK) cells with noninfectious SARS-CoV-2, in which the spike protein in the...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails ArticlePubMed
TargetReplicase polyprotein 1ab(2019-nCoV)
Yale University

LigandPNGBDBM484213(Inhibitor 21 of SARS-CoV-2 Mpro)
Affinity DataIC50:  61nMAssay Description:Purified protein is diluted in reaction buffer to 100 nM in an opaque 96-well plate. The protein is incubated with or without compound in DMSO at dif...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails ArticlePubMed