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BDBM264869 US9718792, 64

SMILES: C[C@@](C[C@H]1CC(=NO1)c1ccc(cc1)-c1ccc(nc1)C(F)(F)F)(C(=O)NO)S(C)(=O)=O

InChI Key: InChIKey=SVBUEOBCFFOLAW-DNVCBOLYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 264869   
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
UDP-3-O-acyl-N-acetylglucosamine deacetylase


(Pseudomonas aeruginosa)
BDBM264869
PNG
(US9718792, 64)
Show SMILES C[C@@](C[C@H]1CC(=NO1)c1ccc(cc1)-c1ccc(nc1)C(F)(F)F)(C(=O)NO)S(C)(=O)=O |r,c:5|
Show InChI InChI=1S/C20H20F3N3O5S/c1-19(18(27)25-28,32(2,29)30)10-15-9-16(26-31-15)13-5-3-12(4-6-13)14-7-8-17(24-11-14)20(21,22)23/h3-8,11,15,28H,9-10H2,1-2H3,(H,25,27)/t15-,19-/m1/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
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PC cid
PC sid
UniChem
US Patent
n/an/a<0.00100n/an/an/an/a7.525



Novartis AG

US Patent


Assay Description
The P. aeruginosa LpxC protein is produced according to the general method of Hyland et al (Journal of Bacteriology 1997 179, 2029-2037: Cloning, exp...


US Patent US9718792 (2017)


BindingDB Entry DOI: 10.7270/Q2XG9T4Z
More data for this
Ligand-Target Pair