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Record - 1 of 3   [TOP]
Compound IDNVIC0056
Compound Structure
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InhibitorPMA(Phorbol 12-myristate 13-acetate)
SMILESCCCCCCCCCCCCCC(=O)OC1C(C2(C(C=C(CC3(C2C=C(C3=O)C)O)CO)C4C1(C4(C)C)OC(=O)C)O)C
PubChem ID 27924
Drug Bank ID\N
ChemSpider ID25977
TargetActivates PKC mediated pathways
Assay TypeHTS immunolabeling assay
Assay DescriptionNon-linear regression analysis
Assay Source\N
Cell TypeVero cells
IC50 (nM)372120.0
EC50 (in nM)0.0
OutcomeInhibition of viral replication
Molecular Weight (in g/mol)616.83
H-bond Acceptor8
H-bond Donor3
No. of Rotatable Bonds17
LogP6.51
Topological Polar Surface Area (Å)130.36
PUBMED ID20668647
Referencehttps://www.ncbi.nlm.nih.gov/pmc/articles/PMC2910441/
Curator Email IDkanikatuteja@gmail.com

                  
Record - 2 of 3   [TOP]
Compound IDNVIC0079
Compound Structure
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InhibitorOleic Acid
SMILESCCCCCCCCC=CCCCCCCCC(=O)O
PubChem ID 445639
Drug Bank ID\N
ChemSpider ID393217
TargetActivates PKC mediated pathways
Assay TypeHTS immunolabeling assay
Assay DescriptionNon-linear regression analysis
Assay Source\N
Cell TypeVero cells
IC50 (nM)1848200.0
EC50 (in nM)0.0
OutcomeInhibition of viral replication
Molecular Weight (in g/mol)282.47
H-bond Acceptor2
H-bond Donor1
No. of Rotatable Bonds15
LogP8.19
Topological Polar Surface Area (Å)37.30
PUBMED ID20668647
Referencehttps://www.ncbi.nlm.nih.gov/pmc/articles/PMC2910441/
Curator Email IDkanikatuteja@gmail.com

                  
Record - 3 of 3   [TOP]
Compound IDNVIC0087
Compound Structure
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Inhibitor7-octyl-indolactam
SMILESCCCCCCCCC1=C2CC(NC(=O)C(N(C3=CC=CC(=C23)N1)C)C(C)C)CO
PubChem ID 45934410
Drug Bank ID\N
ChemSpider ID57263232
TargetActivates PKC mediated pathways
Assay TypeHTS immunolabeling assay
Assay DescriptionNon-linear regression analysis
Assay Source\N
Cell TypeVero cells
IC50 (nM)306820.0
EC50 (in nM)0.0
OutcomeInhibition of viral replication
Molecular Weight (in g/mol)413.61
H-bond Acceptor5
H-bond Donor3
No. of Rotatable Bonds9
LogP5.62
Topological Polar Surface Area (Å)68.36
PUBMED ID20668647
Referencehttps://www.ncbi.nlm.nih.gov/pmc/articles/PMC2910441/
Curator Email IDkanikatuteja@gmail.com