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Compound IDNVIC0121
Compound Structure
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InhibitorIonomycin
SMILESCC(CCC(=O)O)CC(C)CC(C)C(=O)C=C(C(C)CC(C)CC=CC(C)C(C(C)C(CC1CCC(O1)(C)C2CCC(O2)(C)C(C)O)O)O)O
PubChem ID 6912226
Drug Bank ID\N
ChemSpider ID5288579
TargetCalcium ionophore
Assay TypeHTS immunolabeling assay
Assay DescriptionNon-linear regression analysis
Assay Source\N
Cell TypeVero cells
IC50 (nM)5190.0
EC50 (in nM)0.0
OutcomeInhibition of henipavirus replication
Molecular Weight (in g/mol)709.02
H-bond Acceptor9
H-bond Donor5
No. of Rotatable Bonds22
LogP7.69
Topological Polar Surface Area (Å)153.75
PUBMED ID20668647
Referencehttps://www.ncbi.nlm.nih.gov/pmc/articles/PMC2910441/
Curator Email IDkanikatuteja@gmail.com