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Compile Data Set for Download or QSAR

Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 368.3
BDBM50385560

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB (change energy unit to kcal/mol)

Found 1 hit in this display   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Polymerase acidic protein


(Hepatitis C virus)
BDBM50385560
PNG
(CHEMBL2040638)
Show SMILES COCOn1c(=O)c(=Cc2ccccc2)[nH]c(=Cc2ccc(F)cc2)c1=O |w:8.8,17.18|
Show InChI InChI=1S/C20H17FN2O4/c1-26-13-27-23-19(24)17(11-14-5-3-2-4-6-14)22-18(20(23)25)12-15-7-9-16(21)10-8-15/h2-12,22H,13H2,1H3
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
n/an/a>2.00E+5n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of cap 1 ALMV primed Influenza transcriptase


J Org Chem 66: 5504-16 (2001)


BindingDB Entry DOI: 10.7270/Q298882D
More data for this
Ligand-Target Pair