Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 283.1 BDBM50339861

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB (change energy unit to kcal/mol)

Found 1 hit in this display   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Beta-lactamase (Enterobacter cloacae)	BDBM50339861 (6-(3-((dimethylamino)methyl)phenoxy)benzo[c][1,2]o...) Show SMILES CN(C)Cc1cccc(Oc2ccc3COB(O)c3c2)c1 Show InChI InChI=1S/C16H18BNO3/c1-18(2)10-12-4-3-5-14(8-12)21-15-7-6-13-11-20-17(19)16(13)9-15/h3-9,19H,10-11H2,1-2H3	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	7.72E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Anacor Pharmaceuticals, Inc. Curated by ChEMBL					Assay Description Inhibition of Enterobacter cloacae P99 beta-lactamase AmpC P99 using nitrocefin as substrate after 30 mins by spectrophotometric analysis				Bioorg Med Chem Lett 21: 2533-6 (2011) Article DOI: 10.1016/j.bmcl.2011.02.024 BindingDB Entry DOI: 10.7270/Q2G44QK5
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