BDBM50130808 1-Methyl-3-[6-(5-nitro-indol-1-yl)-hexyloxycarbonyl]-pyridinium; iodide::CHEMBL324271

SMILES: C[n+]1cccc(c1)C(=O)OCCCCCCn1ccc2cc(ccc12)[N+]([O-])=O

InChI Key: InChIKey=OPBKUTIQGQAKMH-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 = 50130808   

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
NH(3)-dependent NAD(+) synthetase (Bacillus subtilis)	BDBM50130808 (1-Methyl-3-[6-(5-nitro-indol-1-yl)-hexyloxycarbony...) Show SMILES C[n+]1cccc(c1)C(=O)OCCCCCCn1ccc2cc(ccc12)[N+]([O-])=O Show InChI InChI=1S/C21H24N3O4/c1-22-11-6-7-18(16-22)21(25)28-14-5-3-2-4-12-23-13-10-17-15-19(24(26)27)8-9-20(17)23/h6-11,13,15-16H,2-5,12,14H2,1H3/q+1	PDB MMDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
University of Alabama at Birmingham Curated by ChEMBL					Assay Description Inhibitory activity against Bacillus subtilis NAD synthetase				J Med Chem 46: 3371-81 (2003) Article DOI: 10.1021/jm030003x BindingDB Entry DOI: 10.7270/Q25T3M6Q
					More data for this Ligand-Target Pair