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SMILES: CC(C)(C)CCN1N2CCCCC2C(=O)C(C1=O)C1=Nc2ccc(NS(C)(=O)=O)cc2S(=O)(=O)N1

InChI Key: InChIKey=NZKOPLBHLRSARE-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 30455   
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
Genome polyprotein


(Hepatitis C virus genotype 1b (isolate BK) (HCV))
BDBM30455
PNG
(hexahydro-1H-pyrido[1,2-b]pyridazin-2-one, 4f)
Show SMILES CC(C)(C)CCN1N2CCCCC2C(=O)C(C1=O)C1=Nc2ccc(NS(C)(=O)=O)cc2S(=O)(=O)N1 |t:20|
Show InChI InChI=1S/C22H31N5O6S2/c1-22(2,3)10-12-27-21(29)18(19(28)16-7-5-6-11-26(16)27)20-23-15-9-8-14(24-34(4,30)31)13-17(15)35(32,33)25-20/h8-9,13,16,18,24H,5-7,10-12H2,1-4H3,(H,23,25)
PDB

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DrugBank
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PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a 41n/a 110n/an/a7.528



Anadys Pharmaceuticals



Assay Description
Assays were performed in a 96-well streptavidin-coated Flash-Plate using enzyme, RNA substrate, and [alpha-33P]GTP/GTP with inhibitor concentration v...


Bioorg Med Chem Lett 18: 5002-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.08.017
BindingDB Entry DOI: 10.7270/Q2XW4H5X
More data for this
Ligand-Target Pair