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SMILES: OC(=O)c1ccccc1-c1nnc(SCC(=O)Nc2cccc(c2)[N+]([O-])=O)[nH]1

InChI Key: InChIKey=SLOBRYKYHRELOU-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50089393   
Target/Host
(Institution)		LigandTarget/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		pHTemp
°C
Beta-lactamase


(Aeromonas veronii)		BDBM50089393
PNG
(CHEMBL3577970)
Show SMILES OC(=O)c1ccccc1-c1nnc(SCC(=O)Nc2cccc(c2)[N+]([O-])=O)[nH]1
Show InChI InChI=1S/C17H13N5O5S/c23-14(18-10-4-3-5-11(8-10)22(26)27)9-28-17-19-15(20-21-17)12-6-1-2-7-13(12)16(24)25/h1-8H,9H2,(H,18,23)(H,24,25)(H,19,20,21)
PDB

UniProtKB/TrEMBL

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PC sid
UniChem

Similars
Article
PubMed
 1.90E+3n/an/an/an/an/an/an/an/a



Northwest University

Curated by ChEMBL


Assay Description
Inhibition of Aeromonas veronii metallo-beta-lactamase ImiS expressed in Escherichia coli BL21(DE3) using imipenem substrate pre-incubated for 30 min...

ACS Med Chem Lett 6: 455-60 (2015)


Article DOI: 10.1021/ml500534c
BindingDB Entry DOI: 10.7270/Q2XP76P0
More data for this
Ligand-Target Pair