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SMILES: COc1ccc(cc1Cl)N1C(SCC(=O)N(C(C)C)C(C)C)=N\C(=C\c2ccco2)C1=O

InChI Key: InChIKey=FVASQMJABWKJSZ-XDHOZWIPSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 89150   
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))		BDBM89150
PNG
(2-[(4E)-1-(3-chloranyl-4-methoxy-phenyl)-4-(furan-...)
Show SMILES COc1ccc(cc1Cl)N1C(SCC(=O)N(C(C)C)C(C)C)=N\C(=C\c2ccco2)C1=O |c:22|
Show InChI InChI=1S/C23H26ClN3O4S/c1-14(2)26(15(3)4)21(28)13-32-23-25-19(12-17-7-6-10-31-17)22(29)27(23)16-8-9-20(30-5)18(24)11-16/h6-12,14-15H,13H2,1-5H3/b19-12+
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Similars
PCBioAssay
n/an/an/an/a 1.76E+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