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SMILES: [O-][N+](=O)c1ccc2nc(NC(=O)CC(NC(=O)c3ccccc3)c3ccccc3)sc2c1

InChI Key: InChIKey=STLROCJHRRQOKA-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 25316   
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
ATP phosphoribosyltransferase


(Mycobacterium tuberculosis)		BDBM25316
PNG
(ChemBridge nitrobenzothiazole, 6 | N-(6-nitro-1,3-...)
Show SMILES [O-][N+](=O)c1ccc2nc(NC(=O)CC(NC(=O)c3ccccc3)c3ccccc3)sc2c1
Show InChI InChI=1S/C23H18N4O4S/c28-21(26-23-25-18-12-11-17(27(30)31)13-20(18)32-23)14-19(15-7-3-1-4-8-15)24-22(29)16-9-5-2-6-10-16/h1-13,19H,14H2,(H,24,29)(H,25,26,28)
PDB
MMDB

KEGG

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PC cid
PC sid
UniChem
Article
PubMed
n/an/a 6.00E+3n/an/an/an/a8.522



Yale University



Assay Description
Inhibition activity was determined using an assay that followed the production of PR-ATP spectrophotometrically. Enzymatic reaction was initiated by ...

J Med Chem 51: 5984-92 (2008)


Article DOI: 10.1021/jm800328v
BindingDB Entry DOI: 10.7270/Q2V986CX
More data for this
Ligand-Target Pair