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Compound IDNVIC0043
Compound Structure
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InhibitorG4
SMILESC1CC(OC1)CNC(=O)C(=O)NC2=C3CSCC3=NN2C4=CC=C(C=C4)F
PubChem ID 22584902
Drug Bank ID\N
ChemSpider ID20439076
Targetattachment glycoprotein (Niv-G)
Assay Typemolecular docking and simulation
Assay Description\N
Assay Source\N
Cell Type\N
IC50 (nM)0.0
EC50 (in nM)0.0
Outcomeinhibition of attachment glycoprotein (Niv-G)
Molecular Weight (in g/mol)390.43
H-bond Acceptor8
H-bond Donor2
No. of Rotatable Bonds7
LogP2.45
Topological Polar Surface Area (Å)110.55
PUBMED ID33450550
Referencehttps://pubmed.ncbi.nlm.nih.gov/33450550/
Curator Email IDbhupender.thakur855@gmail.com