BDBM50130798 CHEMBL334066::Trimethyl-{4-[6-(5-nitro-indol-1-yl)-hexyloxycarbonylmethyl]-phenyl}-ammonium; iodide

SMILES: C[N+](C)(C)c1ccc(CC(=O)OCCCCCCn2ccc3cc(ccc23)[N+]([O-])=O)cc1

InChI Key: InChIKey=ZYQCAWQDFFTGDA-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 = 50130798   

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)	BDBM50130798 (CHEMBL334066 | Trimethyl-{4-[6-(5-nitro-indol-1-yl...) Show SMILES C[N+](C)(C)c1ccc(CC(=O)OCCCCCCn2ccc3cc(ccc23)[N+]([O-])=O)cc1 Show InChI InChI=1S/C25H32N3O4/c1-28(2,3)23-11-8-20(9-12-23)18-25(29)32-17-7-5-4-6-15-26-16-14-21-19-22(27(30)31)10-13-24(21)26/h8-14,16,19H,4-7,15,17-18H2,1-3H3/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	8.40E+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