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BDBM50008061 3,5-Difluoro-benzoic acid 6-methyl-6-aza-bicyclo[3.2.1]oct-3-yl ester::CHEMBL32987

SMILES: CN1CC2CC1CC(C2)OC(=O)c1cc(F)cc(F)c1

InChI Key: InChIKey=KNPHZKMIPVOZPG-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50008061   
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
Dopamine Transporter (DAT)


(Rattus norvegicus (rat))
BDBM50008061
PNG
(3,5-Difluoro-benzoic acid 6-methyl-6-aza-bicyclo[3...)
Show SMILES CN1CC2CC1CC(C2)OC(=O)c1cc(F)cc(F)c1
Show InChI InChI=1S/C15H17F2NO2/c1-18-8-9-2-13(18)7-14(3-9)20-15(19)10-4-11(16)6-12(17)5-10/h4-6,9,13-14H,2-3,7-8H2,1H3
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Article
PubMed
n/an/a 9.03E+3n/an/an/an/an/an/a



Research Triangle Institute

Curated by ChEMBL


Assay Description
Inhibition of [3H]3-beta-(p-fluorophenyl)tropane-2beta-carboxylic acid methyl ester [3H]7a binding to Dopamine transporter of rat striatal membranes


J Med Chem 35: 141-4 (1992)


Article DOI: 10.1021/jm00079a018
BindingDB Entry DOI: 10.7270/Q29Z95H8
More data for this
Ligand-Target Pair