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Compile Data Set for Download or QSAR

Found 1 hit of ic50 for monomerid = 50095985   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Amyloid-beta precursor protein


(Homo sapiens (Human))
BDBM50095985
PNG
(CHEMBL3593276)
Show SMILES [O-]S(=O)(=O)C(F)(F)F.CCN1\C(Sc2ccc(OCCCO[N+]([O-])=O)cc12)=C\C=C\c1sc2ccc(OCCCO[N+]([O-])=O)cc2[n+]1CC
Show InChI InChI=1S/C18H27N5O5/c19-15-12-16(22-18(21-15)27-7-6-10-4-2-1-3-5-10)23(9-20-12)17-14(26)13(25)11(8-24)28-17/h9-11,13-14,17,24-26H,1-8H2,(H2,19,21,22)/t11-,13+,14+,17?/m1/s1
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Similars

Article
PubMed
n/an/a 2.60E+4n/an/an/an/an/an/a



Universit£ degli Studi di Torino

Curated by ChEMBL


Assay Description
Inhibition of Amyloid beta (1 to 40) (unknown origin) aggregation assessed as amount of fibrils formation at 100 uM after 2 hrs by thioflavin T based...


Bioorg Med Chem 23: 4688-98 (2015)


Article DOI: 10.1016/j.bmc.2015.05.050
BindingDB Entry DOI: 10.7270/Q29888RC
More data for this
Ligand-Target Pair