BindingDB logo
myBDB logout

null

SMILES: CCN(CC)CCSC(N=O)c1nc(no1)-c1cccc2ccccc12

InChI Key: InChIKey=RCIIRWCCFRILKB-UHFFFAOYSA-N

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50025251   
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))		BDBM50025251
PNG
(CHEMBL302946 | N-Hydroxy-3-naphthalen-1-yl-[1,2,4]...)
Show SMILES CCN(CC)CCSC(N=O)c1nc(no1)-c1cccc2ccccc12
Show InChI InChI=1S/C19H22N4O2S/c1-3-23(4-2)12-13-26-19(21-24)18-20-17(22-25-18)16-11-7-9-14-8-5-6-10-15(14)16/h5-11,19H,3-4,12-13H2,1-2H3
UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars
PubMed
n/an/a 1.30E+3n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
In vitro reversible inhibition of eel acetylcholinesterase.

J Med Chem 29: 2174-83 (1986)


BindingDB Entry DOI: 10.7270/Q2VQ31QK
More data for this
Ligand-Target Pair