Brief Information of the Compound and Protein
Compound Name
(2S)-N-[(1S)-1-cyclohexyl-2-[(2S)-2-[4-(4-fluorobenzoyl)-1,3-thiazol-2-yl]pyrrolidin-1-yl]-2-oxoethyl]-2-(methylamino)propanamide
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PubChem ID
CID: 24737642
SID: 49630901
Canonical SMILES
CN[C@@H](C)C(=O)N[C@@H](C1CCCCC1)C(=O)N1CCC[C@H]1c1nc(cs1)C(=O)c1ccc(F)cc1
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Compound Formula C26H33FN4O3S
Compound Structure
Protein Name
Baculoviral IAP repeat-containing protein 2
Protein Classification
Enzyme
Uniprot ID
Q13490
Gene Name
BIRC2
Table of Molecular Bioactivities Related to the Compound and Protein
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000111 MDA-MB-231 Homo sapiens (Human)  2
1
EC50 = 0.4 nM
   TI
   LI
   LO
   TS
2
IC50 = 0.4 nM
   TI
   LI
   LO
   TS
Biochemical Assays
1 IC50 = 58 nM
2 IC50 = 61 nM
3 IC50 = 2140 nM
4 IC50 = 2720 nM
5 Kd = 10.4 nM