BDBM50605843 CHEMBL5207886

SMILES [H][C@@]12[C@H](NC(=O)COc3ccccc3)C(=O)N1[C@@H](C(=O)OCc1cc(F)c(F)c(F)c1)C(C)(C)S2(=O)=O

InChI Key InChIKey=XZPHNSYKOOCQKN-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 = 50605843   

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

Curated by ChEMBL
LigandPNGBDBM50605843(CHEMBL5207886)
Affinity DataIC50: 5.00E+4nMAssay 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