BDBM50130800 3-[7-(5-Methoxy-indol-1-yl)-heptyloxycarbonyl]-1-methyl-pyridinium; iodide::CHEMBL116227

SMILES: COc1ccc2n(CCCCCCCOC(=O)c3ccc[n+](C)c3)ccc2c1

InChI Key: InChIKey=IHNUJXWFYSRGDZ-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 = 50130800   

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)	BDBM50130800 (3-[7-(5-Methoxy-indol-1-yl)-heptyloxycarbonyl]-1-m...) Show SMILES COc1ccc2n(CCCCCCCOC(=O)c3ccc[n+](C)c3)ccc2c1 Show InChI InChI=1S/C23H29N2O3/c1-24-13-8-9-20(18-24)23(26)28-16-7-5-3-4-6-14-25-15-12-19-17-21(27-2)10-11-22(19)25/h8-13,15,17-18H,3-7,14,16H2,1-2H3/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	2.40E+4	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