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BDBM50313755 1-methyl-3-(3',4',5'-trimethoxyphenyl)-5-phenyl-4,5-dihydro-1H pyrazole::CHEMBL1082880

SMILES: COc1cc(cc(OC)c1OC)C1=NN(C)C(C1)c1ccccc1

InChI Key: InChIKey=LPGZJRNIFDEZLK-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50313755   
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)
BDBM50313755
PNG
(1-methyl-3-(3',4',5'-trimethoxyphenyl)-5-phenyl-4,...)
Show SMILES COc1cc(cc(OC)c1OC)C1=NN(C)C(C1)c1ccccc1 |t:13|
Show InChI InChI=1S/C19H22N2O3/c1-21-16(13-8-6-5-7-9-13)12-15(20-21)14-10-17(22-2)19(24-4)18(11-14)23-3/h5-11,16H,12H2,1-4H3
MMDB

KEGG

UniProtKB/SwissProt

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DrugBank
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CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 8.05E+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