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Compound IDNVIC0064
Compound Structure
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InhibitorVerapamil
PubChem ID 2520
Drug Bank ID
ChemSpider ID 2425
SMILESCC(C)C(CCCN(C)CCC1=CC(=C(C=C1)OC)OC)(C#N)C2=CC(=C(C=C2)OC)OC
Molecular Weight (in g/mol)454.611 g/mol
TargetL/T-type Calcium channel antagonist
Assay TypeHTS immunolabeling assay
Assay DescriptionNon-linear regression analysis
Assay Source
Cell TypeVero cells
Outcomecalcium channel blockage
IC50 (in nM)21660
EC50 (in nM)
H-bond Acceptor5
H-bond Donor0
No. of Rotatable Bond Count13
XLogP4.71
PSA63.95
Reference(s)https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2910441/
PubMed ID [Source Literature] 20668647
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