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SMILES: OC(=O)C1=C(CCC1)C(=O)Nc1cc(Br)c(OCc2c(F)cccc2Cl)c(Br)c1

InChI Key: InChIKey=GCFDRIDFVKBEMX-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50173158   
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
Dihydroorotate dehydrogenase (quinone), mitochondrial


(Homo sapiens (Human))		BDBM50173158
PNG
(2-[3,5-Dibromo-4-(2-chloro-6-fluoro-benzyloxy)-phe...)
Show SMILES OC(=O)C1=C(CCC1)C(=O)Nc1cc(Br)c(OCc2c(F)cccc2Cl)c(Br)c1 |t:3|
Show InChI InChI=1S/C20H15Br2ClFNO4/c21-14-7-10(25-19(26)11-3-1-4-12(11)20(27)28)8-15(22)18(14)29-9-13-16(23)5-2-6-17(13)24/h2,5-8H,1,3-4,9H2,(H,25,26)(H,27,28)
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n/an/a 110n/an/an/an/an/an/a



4SC AG

Curated by ChEMBL


Assay Description
Inhibition of N-terminally truncated recombinant human dihydroorotate dehydrogenase using in vitro enzyme assay

Bioorg Med Chem Lett 15: 4854-7 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.053
BindingDB Entry DOI: 10.7270/Q2HX1C7N
More data for this
Ligand-Target Pair