BDBM50288320 (S)-2-[2-(2-{2-[(S)-2-{[(R)-(R)-1-((S)-4-Carboxy-1-(S)-oxo-butyl)-4-hydroxy-pyrrolidine-2-carbonyl]-amino}-3-((3R,4S)-3,4,5-trihydroxy-6-methyl-tetrahydro-pyran-2-yloxy)-butyrylamino]-ethoxy}-ethoxy)-ethylamino]-pentanedioic acid dihexadecyl ester::CHEMBL276724

SMILES CCCCCCCCCCCCCCCCOC(=O)CC[C@H](NCCOCCOCCNC(=O)[C@@H](NC(=O)[C@H]1C[C@H](O)CN1C(=O)CCCC(O)=O)[C@@H](C)O[C@@H]1O[C@@H](C)[C@@H](O)C(O)C1O)C(=O)OCCCCCCCCCCCCCCCC

InChI Key InChIKey=FMEIAPNAJFASFU-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 = 50288320   

TargetE-selectin(Human)
TBA

Curated by ChEMBL
LigandPNGBDBM50288320((S)-2-[2-(2-{2-[(S)-2-{[(R)-(R)-1-((S)-4-Carboxy-1...)
Affinity DataIC50: 5.00E+5nMAssay Description:Ability to inhibit sialyl Lewis X binding to Selectin E was determinedMore data for this Ligand-Target Pair
In Depth
Date in BDB:
9/26/2012
Entry Details Article