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Compound IDNVIC0016
Compound Structure
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Inhibitor1-N,4-N-bis(3-phenylphenyl)piperazine-1,4-dicarbox
PubChem ID 235811
Drug Bank ID
ChemSpider ID 205764
SMILESC1CN(CCN1C(=O)NC2=CC=CC(=C2)C3=CC=CC=C3)C(=O)NC4=CC=CC(=C4)C5=CC=CC=C5
Molecular Weight (in g/mol)476.6
TargetNiV-G glycoprotein
Assay TypeVirtual screening by Auto dock Vina
Assay DescriptionADME/Tox filter server
Assay SourceNCI diversity set-II
Cell Type
OutcomeInhibit the NiV-G
IC50 (in nM)
EC50 (in nM)
H-bond Acceptor6
H-bond Donor2
No. of Rotatable Bond Count8
XLogP10.1
PSA64.68
Reference(s)https://www.omicsonline.org/open-access/virtual-screening-for-identification-of-small-lead-compound-inhibitors-ofnipah-virus-attachment-glycoprotein-2153-0645-1000180.pdf
PubMed ID [Source Literature] 
Curatornishisharmacool14@gmail.com