BDBM50593606 CHEMBL5189793

SMILES [#6]\[#6](-[#6])=[#6]\[#6]-c1cc(\[#6]=[#6]-2/[#8]-[#6](=O)-[#6](=[#6]-2-[#8])-c2cc3-[#6]-[#6]C([#6])([#6])[#8]-c3cc2-[#8])ccc1-[#8]

InChI Key InChIKey=ZKFXRJQJOQMOFM-UHFFFAOYSA-N

Data  1 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50593606   

TargetReplicase polyprotein 1ab(2019-nCoV)
Yunnan University

Curated by ChEMBL
LigandPNGBDBM50593606(CHEMBL5189793)
Affinity DataIC50: 1.03E+4nMAssay Description:Inhibition of SARS-CoV-2 MPro incubated for 5 mins by FRET assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
6/21/2023
Entry Details Article
PubMed