BDBM17291 E2-adenosine hybrid compound, 9::[5-(6-amino-9H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl 10-[(1S,10R,11S,14S,15S)-5,14-dihydroxy-15-methyltetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadeca-2,4,6-trien-13-yl]decanoate

SMILES [H][C@@]12CC(CCCCCCCCCC(=O)OCC3OC(C(O)C3O)n3cnc4c(N)ncnc34)[C@H](O)[C@@]1(C)CC[C@]1([H])c3ccc(O)cc3CC[C@@]21[H]

InChI Key InChIKey=ZSPKKSHQSXRCOB-UHFFFAOYSA-N

Data  1 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 17291   

LigandPNGBDBM17291([5-(6-amino-9H-purin-9-yl)-3,4-dihydroxyoxolan-2-y...)
Affinity DataIC50: 140nMpH: 7.4 T: 2°CAssay Description:The enzymatic reaction was performed in the reaction buffer containing substrate, [14C]-estrone, and the test inhibitors. After the reaction, radiola...More data for this Ligand-Target Pair
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Date in BDB:
8/18/2007
Entry Details Article
PubMed