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BDBM50013613 3-[2-(1-Carboxy-3-phenyl-propylamino)-propionyl]-2-(4-chloro-3-sulfamoyl-phenyl)-thiazolidine-4-carboxylic acid::CHEMBL296344

SMILES: C[C@H](N[C@@H](CCc1ccccc1)C(O)=O)C(=O)N1[C@@H](CSC1c1ccc(Cl)c(c1)S(N)(=O)=O)C(O)=O

InChI Key: InChIKey=YPEJAWXHXQODRG-JPNFTNKFSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50013613   
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)
BDBM50013613
PNG
(3-[2-(1-Carboxy-3-phenyl-propylamino)-propionyl]-2...)
Show SMILES C[C@H](N[C@@H](CCc1ccccc1)C(O)=O)C(=O)N1[C@@H](CSC1c1ccc(Cl)c(c1)S(N)(=O)=O)C(O)=O
Show InChI InChI=1S/C23H26ClN3O7S2/c1-13(26-17(22(29)30)10-7-14-5-3-2-4-6-14)20(28)27-18(23(31)32)12-35-21(27)15-8-9-16(24)19(11-15)36(25,33)34/h2-6,8-9,11,13,17-18,21,26H,7,10,12H2,1H3,(H,29,30)(H,31,32)(H2,25,33,34)/t13-,17-,18-,21?/m0/s1
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
PubMed
n/an/a 8n/an/an/an/an/an/a



Rorer Central Research

Curated by ChEMBL


Assay Description
In vitro inhibition of angiotensin I converting enzyme (ACE) in rabbit lung


J Med Chem 33: 1606-15 (1990)


BindingDB Entry DOI: 10.7270/Q2CF9QPK
More data for this
Ligand-Target Pair