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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Transporter' and Ligand = 'BDBM50062766'   
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
Transporter


(Rattus norvegicus)
BDBM50062766
PNG
(CHEMBL3397801)
Show SMILES COc1ccc(CN[C@@H]2CO[C@@H](C[C@H]2O)C(c2ccccc2)c2ccccc2)c(F)c1 |r|
Show InChI InChI=1S/C26H28FNO3/c1-30-21-13-12-20(22(27)14-21)16-28-23-17-31-25(15-24(23)29)26(18-8-4-2-5-9-18)19-10-6-3-7-11-19/h2-14,23-26,28-29H,15-17H2,1H3/t23-,24-,25+/m1/s1
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PC cid
PC sid
UniChem

Similars

Article
PubMed
9.30n/an/an/an/an/an/an/an/a



Wayne State University

Curated by ChEMBL


Assay Description
Inhibition of [ring 2,5,6-3H]dopamine reuptake in rat cerebral cortex NET


Bioorg Med Chem 23: 821-8 (2015)


Article DOI: 10.1016/j.bmc.2014.12.040
BindingDB Entry DOI: 10.7270/Q2SQ921P
More data for this
Ligand-Target Pair