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BDBM50232947 CHEMBL4097540

SMILES: CCN(CC)c1nc(Nc2ccc(F)cc2)nc(OCC(F)(F)C(F)F)n1

InChI Key: InChIKey=TXKAOLCVZVNVKH-UHFFFAOYSA-N

Data: 1 EC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50232947   
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))
BDBM50232947
PNG
(CHEMBL4097540)
Show SMILES CCN(CC)c1nc(Nc2ccc(F)cc2)nc(OCC(F)(F)C(F)F)n1
Show InChI InChI=1S/C16H18F5N5O/c1-3-26(4-2)14-23-13(22-11-7-5-10(17)6-8-11)24-15(25-14)27-9-16(20,21)12(18)19/h5-8,12H,3-4,9H2,1-2H3,(H,22,23,24,25)
PDB

UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 4.80E+3n/an/an/an/a



University of California

Curated by ChEMBL


Assay Description
Activation of human CFTR expressed in FRT cells co-expressing YFP assessed as increase in forskolin-stimulated iodide influx measured after 10 mins f...


J Med Chem 60: 1210-1218 (2017)


Article DOI: 10.1021/acs.jmedchem.6b01792
BindingDB Entry DOI: 10.7270/Q2ZC8540
More data for this
Ligand-Target Pair