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BDBM23290 (2E)-3-[4-chloro-2-(trifluoromethyl)phenyl]-N-hydroxyprop-2-enamide::hydroxamate derivative, 5g

SMILES: ONC(=O)\C=C\c1ccc(Cl)cc1C(F)(F)F

InChI Key: InChIKey=QPIVGZVHNQGGEK-DUXPYHPUSA-N

Data: 1 IC50

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   Substructure
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Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 23290   
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
Botulinum Neurotoxin Type A


(Clostridium botulinum)
BDBM23290
PNG
((2E)-3-[4-chloro-2-(trifluoromethyl)phenyl]-N-hydr...)
Show SMILES ONC(=O)\C=C\c1ccc(Cl)cc1C(F)(F)F
Show InChI InChI=1S/C10H7ClF3NO2/c11-7-3-1-6(2-4-9(16)15-17)8(5-7)10(12,13)14/h1-5,17H,(H,15,16)/b4-2+
PDB
MMDB

KEGG

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 600n/an/an/an/a7.423



The Scripps Research Institute



Assay Description
Recombinant BoNT LC/A activity was measured in black 96-well microtiter plates by use of a Molecular Devices (Sunnyvale, CA) SpectraMax GeminiEM plat...


Bioorg Med Chem Lett 17: 6463-6 (2007)


Article DOI: 10.1016/j.bmcl.2007.09.103
BindingDB Entry DOI: 10.7270/Q20G3HFM
More data for this
Ligand-Target Pair