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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Dopamine Transporter (DAT)' and Ligand = 'BDBM50041630'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Dopamine Transporter (DAT)


(Rattus norvegicus (rat))
BDBM50041630
PNG
((2S,5R)-8-(2-Fluoro-ethyl)-3-(4-iodo-phenyl)-8-aza...)
Show SMILES COC(=O)[C@@H]1C2CC[C@H](CC1c1ccc(I)cc1)N2CCF
Show InChI InChI=1S/C17H21FINO2/c1-22-17(21)16-14(11-2-4-12(19)5-3-11)10-13-6-7-15(16)20(13)9-8-18/h2-5,13-16H,6-10H2,1H3/t13-,14?,15?,16+/m1/s1
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PC cid
PC sid
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Similars

Article
PubMed
4n/an/an/an/an/an/an/an/a



Research Biochemicals International

Curated by ChEMBL


Assay Description
Binding affinity for dopamine transporters in rat brain tissue.


J Med Chem 37: 1558-61 (1994)


Article DOI: 10.1021/jm00037a004
BindingDB Entry DOI: 10.7270/Q2P55P4H
More data for this
Ligand-Target Pair