BDBM50656726 CHEMBL6144973

SMILES CCC(C(=O)Nc1cc(NC2CNC2)ccc1C)n1cc(Cl)cc2nc(SCc3ccc(F)cc3)nc1-2

InChI Key InChIKey=HEOKJVUWOBSOSB-UHFFFAOYSA-N

Data  1 IC50  1 Kd

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

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50656726   

TargetReplicase polyprotein 1ab(2019-nCoV)
Comenius University Bratislava

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50656726BDBM50656726(CHEMBL6144973)
Affinity DataIC50: 90nMAssay Description:Inhibition of SARS-CoV-2 3CL protease by FRET assayMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In Depth
Date in BDB:
6/4/2026
Entry Details
PubMed
TargetReplicase polyprotein 1ab(2019-nCoV)
Comenius University Bratislava

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50656726BDBM50656726(CHEMBL6144973)
Affinity DataKd:  100nMAssay Description:Binding affinity to SARS-CoV-2 3CL protease assessed as dissociation constant by SPR analysisMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In Depth
Date in BDB:
6/4/2026
Entry Details
PubMed