BDBM50309908 (1S,5R)-2-(azocan-4-ylcarbamoyl)-7-oxo-2,6-diazabicyclo[3.2.0]heptane-6-sulfonic acid::(1S,5R)-2-(azocan-4-ylcarbamoyl)-7-oxo-2,6-diazabicyclo[3.2.0]heptane-6-sulfonic acid methan::CHEMBL590145

SMILES: OS(=O)(=O)N1[C@@H]2CCN([C@@H]2C1=O)C(=O)NC1CCCCNCC1

InChI Key: InChIKey=CNYHZQQWFORPSF-ZOCYIJKUSA-N

Data: 2 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 2 hits for monomerid = 50309908   

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
Beta-lactamase (Pseudomonas aeruginosa (PAO1))	BDBM50309908 ((1S,5R)-2-(azocan-4-ylcarbamoyl)-7-oxo-2,6-diazabi...) Show SMILES OS(=O)(=O)N1[C@@H]2CCN([C@@H]2C1=O)C(=O)NC1CCCCNCC1 |r| Show InChI InChI=1S/C13H22N4O5S/c18-12-11-10(17(12)23(20,21)22)5-8-16(11)13(19)15-9-3-1-2-6-14-7-4-9/h9-11,14H,1-8H2,(H,15,19)(H,20,21,22)/t9?,10-,11+/m1/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	2.50E+4	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
Beta-lactamase (Pseudomonas aeruginosa (PAO1))	BDBM50309908 ((1S,5R)-2-(azocan-4-ylcarbamoyl)-7-oxo-2,6-diazabi...) Show SMILES OS(=O)(=O)N1[C@@H]2CCN([C@@H]2C1=O)C(=O)NC1CCCCNCC1 |r| Show InChI InChI=1S/C13H22N4O5S/c18-12-11-10(17(12)23(20,21)22)5-8-16(11)13(19)15-9-3-1-2-6-14-7-4-9/h9-11,14H,1-8H2,(H,15,19)(H,20,21,22)/t9?,10-,11+/m1/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	1.30E+3	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