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BDBM30439 pyridazinone derivative, 8r

SMILES: CC(C)CCn1nc(-c2cccs2)c(O)c(C2=Nc3ccc(cc3S(=O)(=O)N2)N2CCCC2=O)c1=O

InChI Key: InChIKey=CYMNTYAOQAKOCP-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 30439   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Non-structural protein 5B (NS5B)


(Hepatitis C virus genotype 1b (isolate BK) (HCV))
BDBM30439
PNG
(pyridazinone derivative, 8r)
Show SMILES CC(C)CCn1nc(-c2cccs2)c(O)c(C2=Nc3ccc(cc3S(=O)(=O)N2)N2CCCC2=O)c1=O
Show InChI InChI=1S/C24H25N5O5S2/c1-14(2)9-11-29-24(32)20(22(31)21(26-29)17-5-4-12-35-17)23-25-16-8-7-15(28-10-3-6-19(28)30)13-18(16)36(33,34)27-23/h4-5,7-8,12-14,31H,3,6,9-11H2,1-2H3,(H,25,27)
PDB

UniProtKB/SwissProt

DrugBank
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PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 7.20E+3n/an/an/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: 1413-8 (2008)


Article DOI: 10.1016/j.bmcl.2008.01.007
BindingDB Entry DOI: 10.7270/Q22N50MR
More data for this
Ligand-Target Pair