BDBM50605839 CHEMBL5174185

SMILES [H][C@@]12N([C@@H](C(=O)OCc3ccc(cc3)[N+]([O-])=O)C(C)(C)[S+]1[O-])C(=O)C2(Br)Br

InChI Key InChIKey=JXEUENXIFMCCAS-UHFFFAOYSA-N

Data  1 IC50

  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 1 hit for monomerid = 50605839   

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

Curated by ChEMBL
LigandPNGBDBM50605839(CHEMBL5174185)
Affinity DataIC50: 500nMAssay 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