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BDBM50339280 3-(Naphthalen-1-yl)-2,5-bis(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-7(4H)-one::CHEMBL1689653

SMILES: FC(F)(F)c1[nH]n2c(nc(cc2=O)C(F)(F)F)c1-c1cccc2ccccc12

InChI Key: InChIKey=XLVQKUBZQAUDRE-UHFFFAOYSA-N

Data: 1 EC50

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   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50339280   
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
Voltage-gated potassium channel subunit Kv7.2/Kv7.3


(Homo sapiens (Human))
BDBM50339280
PNG
(3-(Naphthalen-1-yl)-2,5-bis(trifluoromethyl)pyrazo...)
Show SMILES FC(F)(F)c1[nH]n2c(nc(cc2=O)C(F)(F)F)c1-c1cccc2ccccc12 |(12.13,-33.97,;11.37,-35.32,;9.82,-35.33,;10.58,-33.97,;12.15,-36.65,;11.53,-38.06,;12.68,-39.08,;14.01,-38.31,;15.34,-39.09,;15.34,-40.63,;14.01,-41.4,;12.67,-40.63,;11.33,-41.41,;16.68,-41.41,;16.68,-42.96,;18.02,-40.64,;18.02,-42.18,;13.68,-36.8,;14.51,-35.5,;13.79,-34.14,;14.62,-32.83,;16.17,-32.9,;16.88,-34.27,;18.41,-34.34,;19.13,-35.69,;18.3,-37,;16.76,-36.93,;16.05,-35.57,)|
Show InChI InChI=1S/C18H9F6N3O/c19-17(20,21)12-8-13(28)27-16(25-12)14(15(26-27)18(22,23)24)11-7-3-5-9-4-1-2-6-10(9)11/h1-8,26H
PDB

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PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 4.98E+3n/an/an/an/a



Hebei Medical University

Curated by ChEMBL


Assay Description
Activation of KCNQ2/Q3 expressed in CHO cells by atomic absorption Rb'+ efflux assay


Eur J Med Chem 46: 934-43 (2011)


Article DOI: 10.1016/j.ejmech.2011.01.010
BindingDB Entry DOI: 10.7270/Q2TM7BDF
More data for this
Ligand-Target Pair