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Compound IDNVIC0001
Compound Structure
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InhibitorOSU-03012
SMILESC1=CC=C2C(=C1)C=CC3=C2C=CC(=C3)C4=CC(=NN4C5=CC=C(C=C5)NC(=O)CN)C(F)(F)F
PubChem ID 10027278
Drug Bank ID\N
ChemSpider ID8202849
TargetPDK-1
Assay TypeReporter assay
Assay DescriptionNon-linear regression analysis
Assay SourceSelleck Chemicals (Houston, TX, USA)
Cell TypeHEK 293T cells
IC50 (nM)0.0
EC50 (in nM)400.0
OutcomeReplication inhibited in NiV-Luc
Molecular Weight (in g/mol)460.46
H-bond Acceptor7
H-bond Donor2
No. of Rotatable Bonds6
LogP8.90
Topological Polar Surface Area (Å)72.42
PUBMED ID25986249
Referencehttps://www.sciencedirect.com/science/article/pii/S0166354215001126?via%3Dihub
Curator Email IDkanikatuteja@gmail.com