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BDBM23651 2-({6-[bis(2-hydroxyethyl)amino]-4,8-bis[bis(3-methylbutyl)amino]pyrimido[5,4-d][1,3]diazin-2-yl}(2-hydroxyethyl)amino)ethan-1-ol::Dipyridamole Analogue, 33

SMILES: CC(C)CCN(CCC(C)C)c1nc(nc2c(nc(nc12)N(CCO)CCO)N(CCC(C)C)CCC(C)C)N(CCO)CCO

InChI Key: InChIKey=HQMKMUZAAPMWAK-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 23651   
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
Equilibrative Nucleoside Transporter 1 (ENT1)


(Homo sapiens (Human))		BDBM23651
PNG
(2-({6-[bis(2-hydroxyethyl)amino]-4,8-bis[bis(3-met...)
Show SMILES CC(C)CCN(CCC(C)C)c1nc(nc2c(nc(nc12)N(CCO)CCO)N(CCC(C)C)CCC(C)C)N(CCO)CCO
Show InChI InChI=1S/C34H64N8O4/c1-25(2)9-13-39(14-10-26(3)4)31-29-30(36-33(37-31)41(17-21-43)18-22-44)32(38-34(35-29)42(19-23-45)20-24-46)40(15-11-27(5)6)16-12-28(7)8/h25-28,43-46H,9-24H2,1-8H3
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Similars
Article
PubMed
n/an/an/an/an/an/an/an/an/a



University of Tennessee Health Science Center



Assay Description
The compounds were tested to determine their ENT1 nucleoside transporter binding ability by a flow cytometric assay using human leukemia K562 cells i...

J Med Chem 50: 3906-20 (2007)


Article DOI: 10.1021/jm070311l
BindingDB Entry DOI: 10.7270/Q2XK8CVN
More data for this
Ligand-Target Pair