BDBM50085428 (3S,3aS,4aS,5S,8R,8aS,9aR)-8-((E)-2,4-Dimethyl-oct-2-enoyloxy)-9a-hydroxy-3,4a-dimethyl-dodecahydro-naphtho[2,3-b]furan-5-carboxylic acid::CHEMBL80488

SMILES CCCCC(C)\C=C(/C)C(=O)O[C@@H]1CC[C@H](C(O)=O)[C@@]2(C)C[C@H]3[C@H](C)CO[C@]3(O)C[C@H]12

InChI Key InChIKey=QPSWVYBJANGZBF-AXHDJRLXSA-N

Data  1 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50085428   

TargetIntegrase(Human immunodeficiency virus 1)
Merck Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50085428((3S,3aS,4aS,5S,8R,8aS,9aR)-8-((E)-2,4-Dimethyl-oct...)
Affinity DataIC50:  1.00E+5nMAssay Description:Inhibitory activity against HIV-1 integraseMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed