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SMILES: Cl.OC(=O)[C@H]1CCCN(CCOCCC2c3ccccc3CCc3ccccc23)C1

InChI Key: InChIKey=BJTZPQBUOUKBID-BOXHHOBZSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50473313   
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
Sodium- and chloride-dependent betaine transporter


(Rattus norvegicus)		BDBM50473313
PNG
(CHEMBL545690)
Show SMILES Cl.OC(=O)[C@H]1CCCN(CCOCCC2c3ccccc3CCc3ccccc23)C1 |r|
Show InChI InChI=1S/C25H31NO3.ClH/c27-25(28)21-8-5-14-26(18-21)15-17-29-16-13-24-22-9-3-1-6-19(22)11-12-20-7-2-4-10-23(20)24;/h1-4,6-7,9-10,21,24H,5,8,11-18H2,(H,27,28);1H/t21-;/m0./s1
UniProtKB/SwissProt

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UniChem
Article
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n/an/a 561n/an/an/an/an/an/a



Novo Nordisk A/S

Curated by ChEMBL


Assay Description
In vitro inhibition of [3H]GABA uptake in rat synaptosomes was determined

J Med Chem 44: 2152-63 (2001)


Article DOI: 10.1021/jm990513k
BindingDB Entry DOI: 10.7270/Q2RB77BX
More data for this
Ligand-Target Pair