BDBM50266801 CHEMBL475967::N-(4-fluorophenyl)-2-(3-(2-(5-nitro-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)vinyl)-1H-indol-1-yl)acetamide

SMILES: [O-][N+](=O)c1c(C=Cc2cn(CC(=O)Nc3ccc(F)cc3)c3ccccc23)[nH]c(=O)[nH]c1=O

InChI Key: InChIKey=PSDSNDLFWBHJAH-UHFFFAOYSA-N

Data: 1 IC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50266801   

Target/Host (Institution)	Ligand	Target/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	pH	Temp °C
Nicotinamide adenine dinucleotide synthetase (NADs) (Bacillus anthracis)	BDBM50266801 (CHEMBL475967 | N-(4-fluorophenyl)-2-(3-(2-(5-nitro...) Show SMILES [O-][N+](=O)c1c(C=Cc2cn(CC(=O)Nc3ccc(F)cc3)c3ccccc23)[nH]c(=O)[nH]c1=O |w:5.4| Show InChI InChI=1S/C22H16FN5O5/c23-14-6-8-15(9-7-14)24-19(29)12-27-11-13(16-3-1-2-4-18(16)27)5-10-17-20(28(32)33)21(30)26-22(31)25-17/h1-11H,12H2,(H,24,29)(H2,25,26,30,31)	PDB MMDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	5.54E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Alabama at Birmingham Curated by ChEMBL					Assay Description Inhibition of Bacillus anthracis NAD synthetase				Bioorg Med Chem Lett 19: 2001-5 (2009) Article DOI: 10.1016/j.bmcl.2009.02.034 BindingDB Entry DOI: 10.7270/Q2ST7PQC
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