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Compound IDNVIC0060
Compound Structure
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InhibitorMibefradil
PubChem ID 60663
Drug Bank ID
ChemSpider ID 54673
SMILESCC(C)C1C2=C(CCC1(CCN(C)CCCC3=NC4=CC=CC=C4N3)OC(=O)COC)C=C(C=C2)F
Molecular Weight495.639 g/mol
TargetT-type calcium channels antagonist
Assay TypeHTS immunolabeling assay
Assay DescriptionNon-linear regression analysis
Assay Source
Cell TypeVero cells
OutcomeCalcium channel blockage
IC50 (in nM)6110
EC50 (in nM)
H-bond Acceptor6
H-bond Donor1
No. of Rotatable Bond Count12
XLogP6.43
PSA67.45
Reference(s)Https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2910441/
PubMed ID [Source Literature] 20668647
CuratorKanikatuteja@gmail.com