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Compile Data Set for Download or QSAR

Found 2 hits of ic50 for monomerid = 150725   
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
Carboxylic ester hydrolase


(Equus caballus (Horse))
BDBM150725
PNG
(4‐bromo‐2‐{[3‐ (trifluorom...)
Show SMILES CCOP(=O)(OCC)Oc1ccc(Br)cc1C(=O)Nc1cccc(c1)C(F)(F)F
Show InChI InChI=1S/C18H18BrF3NO5P/c1-3-26-29(25,27-4-2)28-16-9-8-13(19)11-15(16)17(24)23-14-7-5-6-12(10-14)18(20,21)22/h5-11H,3-4H2,1-2H3,(H,23,24)
PDB
MMDB

UniProtKB/TrEMBL

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 1.43E+4n/an/an/an/an/an/a



Charles University in Prague



Assay Description
The reaction mixture containing phosphate buffer, AChE or BChE and chosen compounds was prepared and intensively stirred. In given times (5, 10, 15, ...


Bioorg Chem 58: 48-52 (2015)


Article DOI: 10.1016/j.bioorg.2014.11.005
BindingDB Entry DOI: 10.7270/Q26D5RQ1
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Electrophorus electricus (Electric eel))
BDBM150725
PNG
(4‐bromo‐2‐{[3‐ (trifluorom...)
Show SMILES CCOP(=O)(OCC)Oc1ccc(Br)cc1C(=O)Nc1cccc(c1)C(F)(F)F
Show InChI InChI=1S/C18H18BrF3NO5P/c1-3-26-29(25,27-4-2)28-16-9-8-13(19)11-15(16)17(24)23-14-7-5-6-12(10-14)18(20,21)22/h5-11H,3-4H2,1-2H3,(H,23,24)
UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 4.61E+4n/an/an/an/an/an/a



Charles University in Prague



Assay Description
The reaction mixture containing phosphate buffer, AChE or BChE and chosen compounds was prepared and intensively stirred. In given times (5, 10, 15, ...


Bioorg Chem 58: 48-52 (2015)


Article DOI: 10.1016/j.bioorg.2014.11.005
BindingDB Entry DOI: 10.7270/Q26D5RQ1
More data for this
Ligand-Target Pair