BDBM50617005 CHEMBL5435034

SMILES [H][C@]12CN([C@H](C(=O)N[C@@H](C[C@@H]3CCNC3=O)C#N)[C@@]1([H])C2(C)C)C(=O)COc1ccc(cc1)C(F)(F)F

InChI Key InChIKey=HKWNDVCJTVEHHD-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 = 50617005   

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

Curated by ChEMBL
LigandPNGBDBM50617005(CHEMBL5435034)
Affinity DataIC50: 160nMAssay Description:Inhibition of C-terminal recombinant SARS-CoV-2 main protease using ALNDFSNSGSDVLYQPPQTSITSAVLQ/SGFRKMAFPS-NH2 and AcSGFRXMAFPS-NH2 as substrate prei...More data for this Ligand-Target Pair
In Depth
Date in BDB:
12/13/2024
Entry Details
PubMed