Brief Information of the Compound and Protein
Compound Name
 Compound Info 
4-nitro-N-[2-(2-phenylsulfanylethylamino)ethyl]benzamide
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 PubChem ID
CID: 132991418
Canonical SMILES
[O-][N+](=O)c1ccc(cc1)C(=O)NCCNCCSc1ccccc1
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Compound Formula C17H19N3O3S
Compound Structure
Protein Name
 Protein Info 
Shiga toxin subunit A
Protein Classification
Enzyme
>
Hydrolase
Uniprot ID
Q9FBI2
Gene Name
STXA
Table of Molecular Bioactivities Related to the Compound and Protein
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000057 Vero
 Cell Line Info 
Chlorocebus sabaeus (Green monkey)  1
1
IC50 = 7960 nM
   TI
   LI
   LO
   TS
Biochemical Assays
1 Kd = 716 nM
2 Ki = 42460 nM