BDBM50498371 CHEMBL3593638

SMILES: COc1ccc(NCc2cccc(c2)[N+]([O-])=O)cc1

InChI Key: InChIKey=DQMQBJQBYREIBB-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 = 50498371   

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
Urease subunit beta (Helicobacter pylori (strain ATCC 700392 / 26695) (...)	BDBM50498371 (CHEMBL3593638) Show SMILES COc1ccc(NCc2cccc(c2)[N+]([O-])=O)cc1 Show InChI InChI=1S/C14H14N2O3/c1-19-14-7-5-12(6-8-14)15-10-11-3-2-4-13(9-11)16(17)18/h2-9,15H,10H2,1H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	3.19E+5	n/a	n/a	n/a	n/a	n/a	n/a
Jishou University Curated by ChEMBL					Assay Description Inhibition of urease isolated from Helicobacter pylori ATCC 43504 assessed as ammonia production incubated for 1.5 hrs prior to testing by indophenol...				Bioorg Med Chem 23: 4508-4513 (2015) Article DOI: 10.1016/j.bmc.2015.06.014 BindingDB Entry DOI: 10.7270/Q2T43X33
					More data for this Ligand-Target Pair