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Compound IDNVIC0052
Compound Structure
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InhibitorVerapamil
SMILESCC(C)C(CCCN(C)CCC1=CC(=C(C=C1)OC)OC)(C#N)C2=CC(=C(C=C2)OC)OC
PubChem ID 2520
Drug Bank ID\N
ChemSpider ID2425
TargetL/T-type Calcium channel antagonist
Assay TypeHTS immunolabeling assay
Assay DescriptionNon-linear regression analysis
Assay Source\N
Cell TypeVero cells
IC50 (nM)21660.0
EC50 (in nM)0.0
OutcomeCalcium channel blockage
Molecular Weight (in g/mol)454.61
H-bond Acceptor5
H-bond Donor0
No. of Rotatable Bonds13
LogP4.71
Topological Polar Surface Area (Å)63.95
PUBMED ID20668647
Referencehttps://www.ncbi.nlm.nih.gov/pmc/articles/PMC2910441/
Curator Email IDkanikatuteja@gmail.com