Brief Information of the Compound and Protein
Compound Name
4-chloro-2-[[2-methylpropyl-[(3R)-piperidin-3-yl]amino]methyl]benzonitrile
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PubChem ID
CID: 44455597
Canonical SMILES
CC(C)CN(Cc1cc(Cl)ccc1C#N)[C@@H]1CCCNC1
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Compound Formula C17H24ClN3
Compound Structure
Protein Name
Nitric oxide synthase, inducible
Protein Classification
Enzyme
Uniprot ID
P35228
Gene Name
NOS2
Table of Molecular Bioactivities Related to the Compound and Protein
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000134 DLD-1 Homo sapiens (Human)  2
1
IC50 = 260 nM
   TI
   LI
   LO
   TS
2
IC50 = 1500 nM
   TI
   LI
   LO
   TS