BDBM50592445 CHEMBL5205913

SMILES Oc1cc2n(Cc3ccccc3)c(SC(Cc3ccco3)C(=O)N3CCOC3=O)nc2cc1Cl

InChI Key InChIKey=GORSVQYEWPOYEY-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 = 50592445   

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

Curated by ChEMBL
LigandPNGBDBM50592445(CHEMBL5205913)
Affinity DataIC50: 4.61E+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