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BDBM23649 2-({6-[bis(2-hydroxyethyl)amino]-4,8-bis(dipentylamino)pyrimido[5,4-d][1,3]diazin-2-yl}(2-hydroxyethyl)amino)ethan-1-ol::Dipyridamole Analogue, 31

SMILES: CCCCCN(CCCCC)c1nc(nc2c(nc(nc12)N(CCO)CCO)N(CCCCC)CCCCC)N(CCO)CCO

InChI Key: InChIKey=RGIFJDVLBSIITL-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 23649   
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))		BDBM23649
PNG
(2-({6-[bis(2-hydroxyethyl)amino]-4,8-bis(dipentyla...)
Show SMILES CCCCCN(CCCCC)c1nc(nc2c(nc(nc12)N(CCO)CCO)N(CCCCC)CCCCC)N(CCO)CCO
Show InChI InChI=1S/C34H64N8O4/c1-5-9-13-17-39(18-14-10-6-2)31-29-30(36-33(37-31)41(21-25-43)22-26-44)32(38-34(35-29)42(23-27-45)24-28-46)40(19-15-11-7-3)20-16-12-8-4/h43-46H,5-28H2,1-4H3
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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