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BDBM50230341 CHEMBL334908

SMILES: [O-][S+](Cc1ncccc1OCC(F)(F)F)c1nc2cscc2[nH]1

InChI Key: InChIKey=CWSKSCRJKNSODL-UHFFFAOYSA-N

Data: 1 IC50

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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50230341   
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
Potassium-transporting ATPase


(Sus scrofa (Pig))
BDBM50230341
PNG
(CHEMBL334908)
Show SMILES [O-][S+](Cc1ncccc1OCC(F)(F)F)c1nc2cscc2[nH]1
Show InChI InChI=1S/C13H10F3N3O2S2/c14-13(15,16)7-21-11-2-1-3-17-10(11)6-23(20)12-18-8-4-22-5-9(8)19-12/h1-5H,6-7H2,(H,18,19)
PDB

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
n/an/a 500n/an/an/an/an/an/a



Hoechst AG

Curated by ChEMBL


Assay Description
In vitro inhibitory concentration against H+/K+ ATPase from pig stomach by probit analysis


J Med Chem 35: 438-50 (1992)


BindingDB Entry DOI: 10.7270/Q2ZG6R5R
More data for this
Ligand-Target Pair