BDBM50605819 CHEMBL5192323

SMILES [H][C@@]12[C@H](NC(=O)COc3ccccc3)C(=O)N1[C@@H](C(=O)OCc1cc(cc(c1)C(F)(F)F)C(F)(F)F)C(C)(C)S2(=O)=O

InChI Key InChIKey=VQNQTADCZYNNCO-UHFFFAOYSA-N

Data  1 IC50

  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 1 hit for monomerid = 50605819   

TargetReplicase polyprotein 1ab(2019-nCoV)
University of Oxford

Curated by ChEMBL
LigandPNGBDBM50605819(CHEMBL5192323)
Affinity DataIC50: 3.53E+4nMAssay Description:Inhibition of recombinant SARS-CoV-2 Main protease using ALNDFSNSGSDVLYQPPQTSITSAVLQ/SGFRKMAFPS-NH2 as substrate preincubated for 45 to 75 mins follo...More data for this Ligand-Target Pair
In Depth
Date in BDB:
6/25/2023
Entry Details
PubMed