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BDBM50016247 CHEMBL3262490

SMILES: CN1C2N(CCc3c2[nH]c2ccccc32)Cc2cc(OC(=O)NCc3ccccc3)ccc12

InChI Key: InChIKey=HHHJRHGRLBSYRY-UHFFFAOYNA-N

Data: 2 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50016247   
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


(Electrophorus electricus (Electric eel))
BDBM50016247
PNG
(CHEMBL3262490)
Show SMILES CN1C2N(CCc3c2[nH]c2ccccc32)Cc2cc(OC(=O)NCc3ccccc3)ccc12
Show InChI InChI=1/C27H26N4O2/c1-30-24-12-11-20(33-27(32)28-16-18-7-3-2-4-8-18)15-19(24)17-31-14-13-22-21-9-5-6-10-23(21)29-25(22)26(30)31/h2-12,15,26,29H,13-14,16-17H2,1H3,(H,28,32)
UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a>1.00E+4n/an/an/an/an/an/a



University of W£rzburg

Curated by ChEMBL


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


Eur J Med Chem 81: 15-21 (2014)


Article DOI: 10.1016/j.ejmech.2014.05.002
BindingDB Entry DOI: 10.7270/Q24B32VG
More data for this
Ligand-Target Pair
Butyrylcholinesterase (BuChE)


(Equus caballus (Horse))
BDBM50016247
PNG
(CHEMBL3262490)
Show SMILES CN1C2N(CCc3c2[nH]c2ccccc32)Cc2cc(OC(=O)NCc3ccccc3)ccc12
Show InChI InChI=1/C27H26N4O2/c1-30-24-12-11-20(33-27(32)28-16-18-7-3-2-4-8-18)15-19(24)17-31-14-13-22-21-9-5-6-10-23(21)29-25(22)26(30)31/h2-12,15,26,29H,13-14,16-17H2,1H3,(H,28,32)
PDB

UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 2.15E+3n/an/an/an/an/an/a



University of W£rzburg

Curated by ChEMBL


Assay Description
Inhibition of equine serum BChE by Ellman's method


Eur J Med Chem 81: 15-21 (2014)


Article DOI: 10.1016/j.ejmech.2014.05.002
BindingDB Entry DOI: 10.7270/Q24B32VG
More data for this
Ligand-Target Pair