BDBM50592430 CHEMBL5170254

SMILES CC(C)(C)c1ccc2n(Cc3ccccc3)c(SCC(=O)N3CCOC3=O)nc2c1

InChI Key InChIKey=CKMLMXGIKGMFOC-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 = 50592430   

TargetReplicase polyprotein 1ab(2019-nCoV)
New York University Abu Dhabi

Curated by ChEMBL
LigandPNGBDBM50592430(CHEMBL5170254)
Affinity DataIC50: 3.51E+4nMAssay Description:Inhibition of His6-tagged SARS-CoV-2 main protease expressed in Escherichia coli BL21 (DE3) using DABCYL-KTSAVLQ1SGFRKM-E(EDANS)-NH2 as substrate pre...More data for this Ligand-Target Pair
In Depth
Date in BDB:
6/20/2023
Entry Details
PubMed