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SMILES: CC(C)CCn1c2cccc(C)c2c(O)c(C2=Nc3ccccc3S(=O)(=O)N2)c1=O

InChI Key: InChIKey=BFAVMKAYKUEKSQ-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50181590   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kcal/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
RNA-directed RNA polymerase


(Hepatitis C virus)		BDBM50181590
PNG
(3-(1,1-dioxo-1,2-dihydrobenzo[1,2,4]thiadiazin-3-y...)
Show SMILES CC(C)CCn1c2cccc(C)c2c(O)c(C2=Nc3ccccc3S(=O)(=O)N2)c1=O |t:17|
Show InChI InChI=1S/C22H23N3O4S/c1-13(2)11-12-25-16-9-6-7-14(3)18(16)20(26)19(22(25)27)21-23-15-8-4-5-10-17(15)30(28,29)24-21/h4-10,13,26H,11-12H2,1-3H3,(H,23,24)
UniProtKB/TrEMBL

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Article
PubMed
n/an/a 206n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Inhibitory activity against HCV delta 21 NS5B RNA polymerase by SPA assay

J Med Chem 49: 971-83 (2006)


Article DOI: 10.1021/jm050855s
BindingDB Entry DOI: 10.7270/Q2N29WJJ
More data for this
Ligand-Target Pair