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SMILES: Cc1cc2N=C3C(CCCC3=Cc3ccc(Br)cc3)C(=Nc2cc1C)c1ccc(Br)cc1

InChI Key: InChIKey=DAQTZXBVKLSYCS-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50448055   
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
Dihydrofolate reductase


(Bos taurus (Cattle))		BDBM50448055
PNG
(CHEMBL3115737)
Show SMILES Cc1cc2N=C3C(CCCC3=Cc3ccc(Br)cc3)C(=Nc2cc1C)c1ccc(Br)cc1 |w:11.12,c:4,21|
Show InChI InChI=1S/C28H24Br2N2/c1-17-14-25-26(15-18(17)2)32-28-21(16-19-6-10-22(29)11-7-19)4-3-5-24(28)27(31-25)20-8-12-23(30)13-9-20/h6-16,24H,3-5H2,1-2H3
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UniChem

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Article
PubMed
n/an/a 2.10E+4n/an/an/an/an/an/a



Future University

Curated by ChEMBL


Assay Description
Inhibition of bovine liver DHFR measured for every 1 min of 10 mins

Eur J Med Chem 74: 234-45 (2014)


Article DOI: 10.1016/j.ejmech.2014.01.004
BindingDB Entry DOI: 10.7270/Q2J67JD9
More data for this
Ligand-Target Pair