Brief Information of the Compound and Protein
Compound Name
 Compound Info 
(S)-1-Benzyl-5-{1-[2-(phenoxymethyl)pyrrolidinyl]sulfonyl}isatin
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 PubChem ID
CID: 9847835
SID: 14809889
Canonical SMILES
O=C1N(Cc2ccccc2)c2ccc(cc2C1=O)S(=O)(=O)N1CCC[C@H]1COc1ccccc1
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Compound Formula C26H24N2O5S
Compound Structure
Protein Name
 Protein Info 
Caspase-3
Protein Classification
Enzyme
>
Protease
>
Cysteine protease
>
Cysteine protease CD clan
>
Cysteine protease C14 family
Uniprot ID
P42574
Gene Name
CASP3
Table of Molecular Bioactivities Related to the Compound and Protein
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000017 HeLa
 Cell Line Info 
Homo sapiens (Human)  1
1
EC50 = 3670 nM
   TI
   LI
   LO
   TS
Biochemical Assays
1 EC50 = 41.8 nM
2 IC50 = 2.5 nM
3 IC50 = 12.2 nM
4 IC50 = 12.3 nM
5 IC50 = 14.5 nM
6 Ki = 1.2 nM