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BDBM58063 2-N-(4-chlorophenyl)-4-N-(furan-2-ylmethyl)-5-nitropyrimidine-2,4,6-triamine::MLS000333145::N-(4-Chloro-phenyl)-N'-furan-2-ylmethyl-5-nitro-pyrimidine-2,4,6-triamine::N2-(4-chlorophenyl)-N4-(2-furanylmethyl)-5-nitropyrimidine-2,4,6-triamine::N2-(4-chlorophenyl)-N4-(furan-2-ylmethyl)-5-nitro-pyrimidine-2,4,6-triamine::SMR000436457::[6-amino-2-(4-chloroanilino)-5-nitro-pyrimidin-4-yl]-(2-furfuryl)amine::cid_3624808

SMILES: Nc1nc(Nc2ccc(Cl)cc2)nc(NCc2ccco2)c1[N+]([O-])=O

InChI Key: InChIKey=MALOHMIENOTYNC-UHFFFAOYSA-N

Data: 1 EC50

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Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 58063   
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
streptokinase A precursor


(Streptococcus pyogenes M1 GAS)		BDBM58063
PNG
(2-N-(4-chlorophenyl)-4-N-(furan-2-ylmethyl)-5-nitr...)
Show SMILES Nc1nc(Nc2ccc(Cl)cc2)nc(NCc2ccco2)c1[N+]([O-])=O
Show InChI InChI=1S/C15H13ClN6O3/c16-9-3-5-10(6-4-9)19-15-20-13(17)12(22(23)24)14(21-15)18-8-11-2-1-7-25-11/h1-7H,8H2,(H4,17,18,19,20,21)
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PCBioAssay
n/an/an/an/a 1.50E+5n/an/an/an/a



Broad Institute

Curated by PubChem BioAssay


Assay Description
Keywords: Group A streptococcus, GAS, streptokinase, expression, virulence, inhibition, dose response, EC50 Assay Overview: The goal of this assa...

PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q2736PBV
More data for this
Ligand-Target Pair