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BDBM50313757 1-methyl-3-(3',4',5'-trimethoxyphenyl)-5-(4''-methoxyphenyl)-4,5-dihydro-1H pyrazole::CHEMBL1082882

SMILES: COc1ccc(cc1)C1CC(=NN1C)c1cc(OC)c(OC)c(OC)c1

InChI Key: InChIKey=SVUIOHBQZIDRBC-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50313757   
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
Angiotensin-converting enzyme


(Oryctolagus cuniculus)
BDBM50313757
PNG
(1-methyl-3-(3',4',5'-trimethoxyphenyl)-5-(4''-meth...)
Show SMILES COc1ccc(cc1)C1CC(=NN1C)c1cc(OC)c(OC)c(OC)c1 |c:11|
Show InChI InChI=1S/C20H24N2O4/c1-22-17(13-6-8-15(23-2)9-7-13)12-16(21-22)14-10-18(24-3)20(26-5)19(11-14)25-4/h6-11,17H,12H2,1-5H3
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
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CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 4.35E+5n/an/an/an/an/an/a



University of Calabria

Curated by ChEMBL


Assay Description
Inhibition of ACE in rabbit lung assessed as decrease in dansylglycine concentration after 5 mins by HPLC analysis


Bioorg Med Chem Lett 20: 1990-3 (2010)


Article DOI: 10.1016/j.bmcl.2010.01.113
BindingDB Entry DOI: 10.7270/Q2G73DW4
More data for this
Ligand-Target Pair