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SMILES: COc1ccc(cc1)-c1nnc(SC(C)C(=O)NCc2ccc3OCOc3c2)n1Cc1ccco1

InChI Key: InChIKey=FCZXXGPLVIGIBI-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 89140   
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
High affinity choline transporter 1


(Homo sapiens (Human))		BDBM89140
PNG
(2-[[4-(2-furfuryl)-5-(4-methoxyphenyl)-1,2,4-triaz...)
Show SMILES COc1ccc(cc1)-c1nnc(SC(C)C(=O)NCc2ccc3OCOc3c2)n1Cc1ccco1
Show InChI InChI=1S/C25H24N4O5S/c1-16(24(30)26-13-17-5-10-21-22(12-17)34-15-33-21)35-25-28-27-23(18-6-8-19(31-2)9-7-18)29(25)14-20-4-3-11-32-20/h3-12,16H,13-15H2,1-2H3,(H,26,30)
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Similars
PCBioAssay
n/an/an/an/a 2.43E+4n/an/an/an/a



Johns Hopkins Ion Channel Center

Curated by PubChem BioAssay


Assay Description
Data Source (MLPCN Center Name): Johns Hopkins Ion Channel Center (JHICC) Center Affiliation: Johns Hopkins University, School of Medicine Screening ...

PubChem Bioassay (2012)


BindingDB Entry DOI: 10.7270/Q21N7ZQ4
More data for this
Ligand-Target Pair