× Home Simple Search Query Builder Structure Search Browse Similarity with FDA Approved Small Molecule Drugs Similarity with ChEMBL compounds Similarity with ZINC Lead-like compounds Cluster Visualization Submission Useful Resources Contact Us
logo
                  
Record - 1 of 1   [TOP]
Compound IDNVIC0063
Compound Structure
DOWNLOAD:
InhibitorTetrandine
PubChem ID 73078
Drug Bank ID
ChemSpider ID 65868
SMILESCN1CCC2=CC(=C3C=C2C1CC4=CC=C(C=C4)OC5=C(C=CC(=C5)CC6C7=C(O3)C(=C(C=C7CCN6C)OC)OC)OC)OC
Molecular Weight622.762 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)654800
EC50 (in nM)
H-bond Acceptor8
H-bond Donor0
No. of Rotatable Bond Count4
XLogP6.09
PSA61.86
Reference(s)Https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2910441/
PubMed ID [Source Literature] 20668647
CuratorKanikatuteja@gmail.com