BDBM50648583 CHEMBL5613344

SMILES COc1cc2nc(SC)n(C(=O)c3ccc(C)cc3)c2cc1OC

InChI Key

  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 = 50648583   

TargetReplicase polyprotein 1ab(2019-nCoV)
Univ. Lille

Curated by ChEMBL
LigandPNGBDBM50648583(CHEMBL5613344)
Affinity DataIC50: 6.80E+3nMAssay Description:Inhibition of SARS-CoV-2 3CLpro using Dabcyl-KTSAVLQSGFRKM-Glu(Edans) as substrate preincubated for 1 hrs in presence of 2 mM GSH followed by substra...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In Depth
Date in BDB:
10/12/2025
Entry Details
PubMed