BDBM50091547 (E)-3-(3,4-Dihydroxy-phenyl)-acrylic acid (2R,3R,4S,5R,6R)-4,5-bis-[(E)-3-(3,4-dihydroxy-phenyl)-acryloyloxy]-6-[(E)-3-(3,4-dihydroxy-phenyl)-acryloyloxymethyl]-2-methoxy-tetrahydro-pyran-3-yl ester::CHEMBL55888

SMILES CO[C@@H]1O[C@H](COC(=O)\C=C\c2ccc(O)c(O)c2)[C@@H](OC(=O)\C=C\c2ccc(O)c(O)c2)[C@H](OC(=O)\C=C\c2ccc(O)c(O)c2)[C@H]1OC(=O)\C=C\c1ccc(O)c(O)c1

InChI Key InChIKey=QTIBUXMYKQAMNK-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 = 50091547   

TargetIntegrase(Human immunodeficiency virus type 1)
Institute of Science and Technology

Curated by ChEMBL
LigandPNGBDBM50091547((E)-3-(3,4-Dihydroxy-phenyl)-acrylic acid (2R,3R,4...)
Affinity DataIC50: 8.96E+4nMAssay Description:Inhibitory activity against HIV-1 integraseMore data for this Ligand-Target Pair
In Depth
Date in BDB:
10/1/2012
Entry Details Article
PubMed