BDBM50184902 CHEMBL407126::cyclo[RGDfK(cypate)]

SMILES [#6]C1([#6])\[#6]-2=[#6]/[#6]=[#6]/[#6]=[#6]-[#6]=[#6]-[#6]3=[#7+](-[#6]-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#6](=O)-[#7]-[#6]-[#6](=O)-[#7]-[#6@H](-[#6]-[#6](-[#8])=O)-[#6](=O)-[#7]-[#6@@H](-[#6]-c4ccccc4)-[#6](=O)-[#7]-[#6@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#6](=O)-[#6](=O)-[#6]-[#6]-[#7]2-c2ccc4ccccc4c12)-c1ccc2ccccc2c1C3([#6])[#6]

InChI Key InChIKey=DTMCUUNUCSOYOL-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 = 50184902   

TargetIntegrin alpha-V/beta-3(Human)
Washington University

Curated by ChEMBL
LigandPNGBDBM50184902(cyclo[RGDfK(cypate)] | CHEMBL407126)
Affinity DataIC50: 63.9nMAssay Description:Displacement of [125I]echistatin from AlphaV-beta-3 integrin receptorMore data for this Ligand-Target Pair
In Depth
Date in BDB:
5/20/2013
Entry Details Article
PubMed