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SMILES: CC(C)N(c1ccc(cc1C)-c1ccc(N(C(C)C)S(=O)(=O)c2ccccc2)c(C)c1)S(=O)(=O)c1ccccc1

InChI Key: InChIKey=PENITELVHCXLIJ-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 175299   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Acetylcholinesterase


(Homo sapiens (Human))
BDBM175299
PNG
(N,N'-(3,3'-dimethylbiphenyl-4,4'-diyl)...)
Show SMILES CC(C)N(c1ccc(cc1C)-c1ccc(N(C(C)C)S(=O)(=O)c2ccccc2)c(C)c1)S(=O)(=O)c1ccccc1
Show InChI InChI=1S/C32H36N2O4S2/c1-23(2)33(39(35,36)29-13-9-7-10-14-29)31-19-17-27(21-25(31)5)28-18-20-32(26(6)22-28)34(24(3)4)40(37,38)30-15-11-8-12-16-30/h7-24H,1-6H3
PDB
MMDB

NCI pathway
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KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 1.01E+5n/an/an/an/a7.7n/a



Government College University



Assay Description
The AChE inhibition activity was determined according to the Ellman's method with slight modifications. Total volume of the reaction mixture was ...


Bioorg Chem 64: 13-20 (2016)


Article DOI: 10.1016/j.bioorg.2015.11.002
BindingDB Entry DOI: 10.7270/Q20V8BJK
More data for this
Ligand-Target Pair