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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Transporter' and Ligand = 'BDBM50444870'   
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 (rat))		BDBM50444870
PNG
(CHEMBL3099485)
Show SMILES Oc1ccc(CN[C@H]2CC[C@@H](Cc3ccccc3)OC2)cc1 |r|
Show InChI InChI=1S/C19H23NO2/c21-18-9-6-16(7-10-18)13-20-17-8-11-19(22-14-17)12-15-4-2-1-3-5-15/h1-7,9-10,17,19-21H,8,11-14H2/t17-,19-/m0/s1
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PC cid
PC sid
UniChem

Similars
Article
PubMed
 240n/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