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Compile Data Set for Download or QSAR

Found 1 hit of ic50 for monomerid = 50385105   
Target/Host
(Institution)
LigandTarget/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
pHTemp
°C
Putative hydrolase


(Pseudomonas aeruginosa (strain UCBPP-PA14))
BDBM50385105
PNG
(CHEMBL2035874 | US10322118, Entry 8b)
Show SMILES CC(C)c1cc(Oc2c(Br)cc(NC(=O)CC(O)=O)cc2Br)ccc1O
Show InChI InChI=1S/C18H17Br2NO5/c1-9(2)12-7-11(3-4-15(12)22)26-18-13(19)5-10(6-14(18)20)21-16(23)8-17(24)25/h3-7,9,22H,8H2,1-2H3,(H,21,23)(H,24,25)
PDB

UniProtKB/TrEMBL

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CHEMBL
MCE
KEGG
PC cid
PC sid
PDB
UniChem
PDB
US Patent
n/an/a 2.70E+3n/an/an/an/an/an/a



AstraZeneca



Assay Description
The first step in characterizing the two compounds identified by high throughput screening was to verify that the inhibition was reproducible using f...


Bioorg Med Chem Lett 19: 4280-3 (2009)


BindingDB Entry DOI: 10.7270/Q2KW5JC9
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)