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BDBM50127978 3-(2,5-Dioxo-2,5-dihydro-pyrrol-1-yl)-benzoic acid::CHEMBL441433

SMILES: OC(=O)c1cccc(c1)N1C(=O)C=CC1=O

InChI Key: InChIKey=ZJGBFJBMTKEFNQ-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50127978   
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


(Tetronarce californica (Pacific electric ray) (Tor...)
BDBM50127978
PNG
(3-(2,5-Dioxo-2,5-dihydro-pyrrol-1-yl)-benzoic acid...)
Show SMILES OC(=O)c1cccc(c1)N1C(=O)C=CC1=O |c:13|
Show InChI InChI=1S/C11H7NO4/c13-9-4-5-10(14)12(9)8-3-1-2-7(6-8)11(15)16/h1-6H,(H,15,16)
PDB
MMDB

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PC sid
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Similars

PubMed
n/an/a 256n/an/an/an/an/an/a



Instituto Politécnico Nacional

Curated by ChEMBL


Assay Description
Inhibitory activity of the compound against acetylcholinesterase (AChE) from Torpedo californica (Irreversible type of inhibition)


Bioorg Med Chem Lett 13: 1825-7 (2003)


BindingDB Entry DOI: 10.7270/Q2416WF2
More data for this
Ligand-Target Pair