BDBM76253 1-[2-[4-(2-thiophen-3-yl-1-benzothiophen-3-yl)phenoxy]ethyl]pyrrolidine::1-[2-[4-[2-(3-thienyl)benzothiophen-3-yl]phenoxy]ethyl]pyrrolidine::1-[2-[4-[2-(3-thiophenyl)-1-benzothiophen-3-yl]phenoxy]ethyl]pyrrolidine::VU0419488-1::cid_46856261

SMILES C(CN1CCCC1)Oc1ccc(cc1)-c1c(sc2ccccc12)-c1ccsc1

InChI Key InChIKey=XYLNQJXKHFPVJW-UHFFFAOYSA-N

Data  1 EC50

  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 = 76253   

TargetIntegrin alpha-4(Human)
Nmmlsc

Curated by PubChem BioAssay
LigandPNGBDBM76253(1-[2-[4-(2-thiophen-3-yl-1-benzothiophen-3-yl)phen...)
Affinity DataEC50: >4.94E+4nMAssay Description:University of New Mexico Assay Overview: Assay Support: 1 R01 HL081062-01 Project Title: HTS for Identification of VLA-4 Allosteric Modulators (ML...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/1/2011
Entry Details
PCBioAssay