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BDBM50212229 CHEMBL3968649

SMILES: COc1cc(c(F)cc1-n1c2CCN(Cc2ccc1=O)S(=O)(=O)Nc1ncccn1)-c1cc(F)cc(Cl)c1

InChI Key: InChIKey=DDJGYBWMSXIWRU-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50212229   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Sodium channel protein type 9 subunit alpha


(Homo sapiens (Human))
BDBM50212229
PNG
(CHEMBL3968649)
Show SMILES COc1cc(c(F)cc1-n1c2CCN(Cc2ccc1=O)S(=O)(=O)Nc1ncccn1)-c1cc(F)cc(Cl)c1
Show InChI InChI=1S/C25H20ClF2N5O4S/c1-37-23-12-19(16-9-17(26)11-18(27)10-16)20(28)13-22(23)33-21-5-8-32(14-15(21)3-4-24(33)34)38(35,36)31-25-29-6-2-7-30-25/h2-4,6-7,9-13H,5,8,14H2,1H3,(H,29,30,31)
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Similars

Article
PubMed
n/an/a 28n/an/an/an/an/an/a



Temple University

Curated by ChEMBL


Assay Description
Inhibition of human Nav1.7 expressed in HEK293 cells at holding potential yielding 20 to 50% inactivation measured after 3 mins by patchXpress electr...


ACS Med Chem Lett 8: 278-280 (2017)


Article DOI: 10.1021/acsmedchemlett.7b00049
BindingDB Entry DOI: 10.7270/Q2QJ7KF5
More data for this
Ligand-Target Pair