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Compound IDNVIC0023
Compound Structure
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InhibitorComp11265
SMILESCC1(C=CC2=CC3=C(C=C2O1)NC(=O)C34CC56C(C4(C)C)CC7(CCCN7C5=O)C(=O)N6)C
PubChem ID 139591449
Drug Bank ID\N
ChemSpider ID\N
TargetRNA-dependent RNA polymerase (RdRp)
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 RNA-dependent RNA polymerase (RdRp)
Molecular Weight (in g/mol)447.53
H-bond Acceptor7
H-bond Donor2
No. of Rotatable Bonds0
LogP3.15
Topological Polar Surface Area (Å)87.74
PUBMED ID36907056
Referencehttps://pubmed.ncbi.nlm.nih.gov/36907056/
Curator Email IDbhupender.thakur855@gmail.com