BDBM50130795 3-[8-(5-Benzyloxy-indol-1-yl)-octyloxycarbonyl]-1-methyl-pyridinium; iodide::CHEMBL330906

SMILES: C[n+]1cccc(c1)C(=O)OCCCCCCCCn1ccc2cc(OCc3ccccc3)ccc12

InChI Key: InChIKey=XUGKTDPAEWECFH-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 = 50130795   

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)	BDBM50130795 (3-[8-(5-Benzyloxy-indol-1-yl)-octyloxycarbonyl]-1-...) Show SMILES C[n+]1cccc(c1)C(=O)OCCCCCCCCn1ccc2cc(OCc3ccccc3)ccc12 Show InChI InChI=1S/C30H35N2O3/c1-31-18-11-14-27(23-31)30(33)34-21-10-5-3-2-4-9-19-32-20-17-26-22-28(15-16-29(26)32)35-24-25-12-7-6-8-13-25/h6-8,11-18,20,22-23H,2-5,9-10,19,21,24H2,1H3/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	2.00E+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