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BDBM50444867 CHEMBL3099488

SMILES: COc1ccc(CCN[C@@H]2CO[C@@H](C2)C(c2ccccc2)c2ccccc2)cc1

InChI Key: InChIKey=GPYMZVYTFCGLID-ZCYQVOJMSA-N

Data: 1 KI

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50444867   
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
Transporter


(Rattus norvegicus (rat))
BDBM50444867
PNG
(CHEMBL3099488)
Show SMILES COc1ccc(CCN[C@@H]2CO[C@@H](C2)C(c2ccccc2)c2ccccc2)cc1 |r|
Show InChI InChI=1S/C26H29NO2/c1-28-24-14-12-20(13-15-24)16-17-27-23-18-25(29-19-23)26(21-8-4-2-5-9-21)22-10-6-3-7-11-22/h2-15,23,25-27H,16-19H2,1H3/t23-,25-/m0/s1
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PC cid
PC sid
UniChem

Similars

Article
PubMed
198n/an/an/an/an/an/an/an/a



Wayne State University

Curated by ChEMBL


Assay Description
Displacement of [3H]-dopamine from rat cerebral cortex NET after 7 mins


Bioorg Med Chem 22: 311-24 (2013)


Article DOI: 10.1016/j.bmc.2013.11.017
BindingDB Entry DOI: 10.7270/Q2FB54D1
More data for this
Ligand-Target Pair