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BDBM50136632 CHEMBL3752955

SMILES: CNC[C@@H]1CC[C@@H](N1S(=O)(=O)c1cc(C)c(F)c(C)c1)c1ccc(F)cc1

InChI Key: InChIKey=WDLWFHKRTNKWLQ-ZSFWTHPBNA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50136632   
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
Transient receptor potential cation channel subfamily A member 1


(Homo sapiens (Human))
BDBM50136632
PNG
(CHEMBL3752955)
Show SMILES CNC[C@@H]1CC[C@@H](N1S(=O)(=O)c1cc(C)c(F)c(C)c1)c1ccc(F)cc1
Show InChI InChI=1/C20H24F2N2O2S/c1-13-10-18(11-14(2)20(13)22)27(25,26)24-17(12-23-3)8-9-19(24)15-4-6-16(21)7-5-15/h4-7,10-11,17,19,23H,8-9,12H2,1-3H3/t17-,19+/s2
PDB

KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a>2.00E+4n/an/an/an/an/an/a



Genentech

Curated by ChEMBL


Assay Description
Inhibition of human TRPA1


Bioorg Med Chem Lett 26: 495-8 (2016)


Article DOI: 10.1016/j.bmcl.2015.11.088
BindingDB Entry DOI: 10.7270/Q23R0VRB
More data for this
Ligand-Target Pair