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SMILES: Cl.Cl.CCN(C)Cc1cc(N)ccc1O

InChI Key: InChIKey=FPWNPXQGVHKBHV-UHFFFAOYSA-N

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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50468999   
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))
BDBM50468999
PNG
(CHEMBL4284261)
Show SMILES Cl.Cl.CCN(C)Cc1cc(N)ccc1O
Show InChI InChI=1S/C10H16N2O/c1-3-12(2)7-8-6-9(11)4-5-10(8)13/h4-6,13H,3,7,11H2,1-2H3
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 9.65E+5n/an/an/an/an/an/a



TNO

Curated by ChEMBL


Assay Description
Inhibition of AChE in human erythrocytes using acetylthiocholine as substrate measured for 1 min


Eur J Med Chem 157: 151-160 (2018)


Article DOI: 10.1016/j.ejmech.2018.08.016
BindingDB Entry DOI: 10.7270/Q2FF3W3C
More data for this
Ligand-Target Pair