BDBM50629506 CHEMBL5394734

SMILES Cc1nc(C)c(COc2cc(Cl)cc(-n3cc(-c4ccc[nH]c4=O)c(=O)n(-c4cccnc4)c3=O)c2)s1

InChI Key InChIKey=PMTPISQRQXCMMZ-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 = 50629506   

TargetReplicase polyprotein 1ab(2019-nCoV)
Emory University

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50629506BDBM50629506(CHEMBL5394734)
Affinity DataIC50: 16nMAssay Description:Inhibition of SARS-CoV-2 main protease expressed in Escherichia coli using [NH2-C(EDANS)VNSTQSGLRK(DABCYL)M-COOH] FRET peptide as substrate pre-incub...More data for this Ligand-Target Pair
In Depth
Date in BDB:
12/19/2024
Entry Details
PubMed