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BDBM50164973 (R)-2-[3-(4-Fluoro-phenoxy)-benzoyl]-1,2,3,4-tetrahydro-isoquinoline-3-carboxylic acid (4-chloro-phenyl)-amide::CHEMBL195151

SMILES: Fc1ccc(Oc2cccc(c2)C(=O)N2Cc3ccccc3C[C@@H]2C(=O)Nc2ccc(Cl)cc2)cc1

InChI Key: InChIKey=IVDSFDCOHULLMD-HHHXNRCGSA-N

Data: 1 EC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50164973   
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))
BDBM50164973
PNG
((R)-2-[3-(4-Fluoro-phenoxy)-benzoyl]-1,2,3,4-tetra...)
Show SMILES Fc1ccc(Oc2cccc(c2)C(=O)N2Cc3ccccc3C[C@@H]2C(=O)Nc2ccc(Cl)cc2)cc1
Show InChI InChI=1S/C29H22ClFN2O3/c30-22-8-12-24(13-9-22)32-28(34)27-17-19-4-1-2-5-21(19)18-33(27)29(35)20-6-3-7-26(16-20)36-25-14-10-23(31)11-15-25/h1-16,27H,17-18H2,(H,32,34)/t27-/m1/s1
PDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

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PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 590n/an/an/an/a



Genzyme Corp.

Curated by ChEMBL


Assay Description
Effective concentration for cellular chloride transport in C127 mouse epithelial cell transfected with recombinant Delta F508 CFTR


Bioorg Med Chem Lett 15: 2087-91 (2005)


Article DOI: 10.1016/j.bmcl.2005.02.041
BindingDB Entry DOI: 10.7270/Q2J965WP
More data for this
Ligand-Target Pair