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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'integrin alpha-L' and Ligand = 'BDBM79607'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
integrin alpha-L


(Mus musculus)
BDBM79607
PNG
(1-[3-[(3,4-difluoroanilino)-oxomethyl]-4-fluorophe...)
Show SMILES CCOC(=O)C1CCCN(C1)S(=O)(=O)c1ccc(F)c(c1)C(=O)Nc1ccc(F)c(F)c1
Show InChI InChI=1S/C21H21F3N2O5S/c1-2-31-21(28)13-4-3-9-26(12-13)32(29,30)15-6-8-17(22)16(11-15)20(27)25-14-5-7-18(23)19(24)10-14/h5-8,10-11,13H,2-4,9,12H2,1H3,(H,25,27)
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PC cid
PC sid
UniChem
PCBioAssay
n/an/an/an/a 1.93E+4n/an/an/an/a



NMMLSC

Curated by PubChem BioAssay


Assay Description
University of New Mexico Assay Overview: Assay Support: 1 X01 MH085707-01 Project Title: HTS for developing T Cell Immune Modulators Assay Provid...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q2XW4H88
More data for this
Ligand-Target Pair