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BDBM50319389 CHEMBL1084650::N,N-dibutyl-10-(4-((diethylamino)methyl)phenoxy)decan-1-amine

SMILES: CCCCN(CCCC)CCCCCCCCCCOc1ccc(CN(CC)CC)cc1

InChI Key: InChIKey=QYZYQXKFXIZEMC-UHFFFAOYSA-N

Data: 2 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50319389   
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
Butyrylcholinesterase (BuChE)


(Equus caballus (Horse))
BDBM50319389
PNG
(CHEMBL1084650 | N,N-dibutyl-10-(4-((diethylamino)m...)
Show SMILES CCCCN(CCCC)CCCCCCCCCCOc1ccc(CN(CC)CC)cc1
Show InChI InChI=1S/C29H54N2O/c1-5-9-23-31(24-10-6-2)25-17-15-13-11-12-14-16-18-26-32-29-21-19-28(20-22-29)27-30(7-3)8-4/h19-22H,5-18,23-27H2,1-4H3
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 15n/an/an/an/an/an/a



Sun Yat-sen University

Curated by ChEMBL


Assay Description
Inhibition of horse serum BChE after 15 mins by Ellman's method


Bioorg Med Chem Lett 20: 3254-8 (2010)


Article DOI: 10.1016/j.bmcl.2010.04.059
BindingDB Entry DOI: 10.7270/Q2QC03P4
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Electrophorus electricus (Electric eel))
BDBM50319389
PNG
(CHEMBL1084650 | N,N-dibutyl-10-(4-((diethylamino)m...)
Show SMILES CCCCN(CCCC)CCCCCCCCCCOc1ccc(CN(CC)CC)cc1
Show InChI InChI=1S/C29H54N2O/c1-5-9-23-31(24-10-6-2)25-17-15-13-11-12-14-16-18-26-32-29-21-19-28(20-22-29)27-30(7-3)8-4/h19-22H,5-18,23-27H2,1-4H3
UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 260n/an/an/an/an/an/a



Sun Yat-sen University

Curated by ChEMBL


Assay Description
Inhibition of electric eel AChE after 15 mins by Ellman's method


Bioorg Med Chem Lett 20: 3254-8 (2010)


Article DOI: 10.1016/j.bmcl.2010.04.059
BindingDB Entry DOI: 10.7270/Q2QC03P4
More data for this
Ligand-Target Pair