× Home About Simple Search Query Builder Structure Search Browse Similarity with FDA Approved Small Molecule Drugs Similarity with COCONUT compounds Similarity with ZINC Lead-like compounds Priority Inhibitors Cluster Visualization Submission Useful Resources Downloads Contact Us
logo
☰
                  
Record - 1 of 1   [TOP]
Compound IDNVIC0029
Compound Structure
DOWNLOAD:
Inhibitor2-APB(2-Aminoethyl Diphenylborinate)
SMILESB(C1=CC=CC=C1)(C2=CC=CC=C2)OCCN
PubChem ID 1598
Drug Bank ID\N
ChemSpider ID1540
TargetInhibitor of IP3 mediated calcium release from the ER
Assay TypeHTS immunolabeling assay
Assay DescriptionNon-linear regression analysis
Assay Source\N
Cell TypeVero cells
IC50 (nM)133310.0
EC50 (in nM)0.0
OutcomeInhibition of henipavirus replication
Molecular Weight (in g/mol)225.10
H-bond Acceptor2
H-bond Donor1
No. of Rotatable Bonds5
LogP4.45
Topological Polar Surface Area (Å)35.25
PUBMED ID20668647
Referencehttps://www.ncbi.nlm.nih.gov/pmc/articles/PMC2910441/
Curator Email IDkanikatuteja@gmail.com