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BDBM50067059 CHEMBL129690::Sodium; (1S,5R)-7-oxo-2-phenylcarbamoyl-2,6-diaza-bicyclo[3.2.0]heptane-6-sulfonate

SMILES: [O-]S(=O)(=O)N1[C@@H]2CCN([C@@H]2C1=O)C(=O)Nc1ccccc1

InChI Key: InChIKey=IOBPNPLVGSCZSV-ZJUUUORDSA-M

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50067059   
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


(Pseudomonas aeruginosa (PAO1))
BDBM50067059
PNG
(CHEMBL129690 | Sodium; (1S,5R)-7-oxo-2-phenylcarba...)
Show SMILES [O-]S(=O)(=O)N1[C@@H]2CCN([C@@H]2C1=O)C(=O)Nc1ccccc1
Show InChI InChI=1S/C12H13N3O5S/c16-11-10-9(15(11)21(18,19)20)6-7-14(10)12(17)13-8-4-2-1-3-5-8/h1-5,9-10H,6-7H2,(H,13,17)(H,18,19,20)/p-1/t9-,10+/m1/s1
PDB

UniProtKB/SwissProt

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PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 420n/an/an/an/an/an/a



F. Hoffmann-La Roche Ltd.

Curated by ChEMBL


Assay Description
Inhibition of P. aeruginosa 18SH Beta-lactamase.


J Med Chem 41: 3961-71 (1998)


Article DOI: 10.1021/jm980023c
BindingDB Entry DOI: 10.7270/Q2HT2NF0
More data for this
Ligand-Target Pair