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BDBM50244715 4-((3-(4-fluoro-3-(trifluoromethyl)phenyl)-4-oxo-2-thioxothiazolidin-5-ylidene)methyl)benzoic acid::CHEMBL460075

SMILES: OC(=O)c1ccc(\C=C2/SC(=S)N(C2=O)c2ccc(F)c(c2)C(F)(F)F)cc1

InChI Key: InChIKey=HRIZDHBBDQTZEK-AUWJEWJLSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50244715   
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
Cystic fibrosis transmembrane conductance regulator


(Homo sapiens (Human))
BDBM50244715
PNG
(4-((3-(4-fluoro-3-(trifluoromethyl)phenyl)-4-oxo-2...)
Show SMILES OC(=O)c1ccc(\C=C2/SC(=S)N(C2=O)c2ccc(F)c(c2)C(F)(F)F)cc1
Show InChI InChI=1S/C18H9F4NO3S2/c19-13-6-5-11(8-12(13)18(20,21)22)23-15(24)14(28-17(23)27)7-9-1-3-10(4-2-9)16(25)26/h1-8H,(H,25,26)/b14-7-
PDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

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PC sid
UniChem

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Similars

Article
PubMed
n/an/a 1.50E+3n/an/an/an/an/an/a



University of California

Curated by ChEMBL


Assay Description
Inhibition of human wild type CFTR expressed in rat FRT cells assessed as chloride current by short-circuit current measurements


Bioorg Med Chem 16: 8187-95 (2008)


Article DOI: 10.1016/j.bmc.2008.07.044
BindingDB Entry DOI: 10.7270/Q27M07S6
More data for this
Ligand-Target Pair