BDBM50130826 CHEMBL326763::{4-[5-(5-Benzyloxy-indol-1-yl)-pentyloxycarbonylmethyl]-phenyl}-trimethyl-ammonium; iodide

SMILES: C[N+](C)(C)c1ccc(CC(=O)OCCCCCn2ccc3cc(OCc4ccccc4)ccc23)cc1

InChI Key: InChIKey=ORBFCUWIDXEPDF-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 = 50130826   

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)	BDBM50130826 (CHEMBL326763 | {4-[5-(5-Benzyloxy-indol-1-yl)-pent...) Show SMILES C[N+](C)(C)c1ccc(CC(=O)OCCCCCn2ccc3cc(OCc4ccccc4)ccc23)cc1 Show InChI InChI=1S/C31H37N2O3/c1-33(2,3)28-14-12-25(13-15-28)22-31(34)35-21-9-5-8-19-32-20-18-27-23-29(16-17-30(27)32)36-24-26-10-6-4-7-11-26/h4,6-7,10-18,20,23H,5,8-9,19,21-22,24H2,1-3H3/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	6.00E+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