Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 331.3 BDBM50309906

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 (Pseudomonas aeruginosa (PAO1))	BDBM50309906 ((1S,5R)-2-(cycloheptylcarbamoyl)-7-oxo-2,6-diazabi...) Show SMILES OS(=O)(=O)N1[C@@H]2CCN([C@@H]2C1=O)C(=O)NC1CCCCCC1 |r| Show InChI InChI=1S/C13H21N3O5S/c17-12-11-10(16(12)22(19,20)21)7-8-15(11)13(18)14-9-5-3-1-2-4-6-9/h9-11H,1-8H2,(H,14,18)(H,19,20,21)/t10-,11+/m1/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	400	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Labs Curated by ChEMBL					Assay Description Inhibition of Pseudomonas aeruginosa beta lactamase AmpC by spectrophotometry				Bioorg Med Chem Lett 20: 918-21 (2010) Article DOI: 10.1016/j.bmcl.2009.12.069 BindingDB Entry DOI: 10.7270/Q2KW5G5S
					More data for this Ligand-Target Pair