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BDBM50285288 2,6-Dichloro-benzoic acid 6-methoxy-1,1,3-trioxo-1,3-dihydro-1lambda*6*-benzo[d]isothiazol-2-ylmethyl ester::CHEMBL274347

SMILES: COc1ccc2C(=O)N(COC(=O)c3c(Cl)cccc3Cl)S(=O)(=O)c2c1

InChI Key: InChIKey=HTXZXSFUUKMNIE-UHFFFAOYSA-N

Data: 1 KI

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50285288   
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
Leukocyte elastase


(Homo sapiens (Human))
BDBM50285288
PNG
(2,6-Dichloro-benzoic acid 6-methoxy-1,1,3-trioxo-1...)
Show SMILES COc1ccc2C(=O)N(COC(=O)c3c(Cl)cccc3Cl)S(=O)(=O)c2c1
Show InChI InChI=1S/C16H11Cl2NO6S/c1-24-9-5-6-10-13(7-9)26(22,23)19(15(10)20)8-25-16(21)14-11(17)3-2-4-12(14)18/h2-7H,8H2,1H3
PDB
MMDB

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PC cid
PC sid
UniChem
Article
0.470n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of Human Leukocyte Elastase (HLE) as apparent binding constant (kreact/kinact)


Bioorg Med Chem Lett 5: 105-109 (1995)


Article DOI: 10.1016/0960-894X(94)00466-S
BindingDB Entry DOI: 10.7270/Q2V69JJN
More data for this
Ligand-Target Pair