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BDBM50042828 4-Hydroxy-1-(9-mercaptomethyl-10-oxo-azecane-2-carbonyl)-pyrrolidine-2-carboxylic acid::CHEMBL124536

SMILES: O[C@@H]1C[C@H](N(C1)C(=O)C1CCCCCCC(CS)C(=O)N1)C(O)=O

InChI Key: InChIKey=YNQXQNNKLCWMGX-KPFVRQRISA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50042828   
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
Neutral Endopeptidase (NEP)


(Rattus norvegicus (Rat))
BDBM50042828
PNG
(4-Hydroxy-1-(9-mercaptomethyl-10-oxo-azecane-2-car...)
Show SMILES O[C@@H]1C[C@H](N(C1)C(=O)C1CCCCCCC(CS)C(=O)N1)C(O)=O
Show InChI InChI=1S/C16H26N2O5S/c19-11-7-13(16(22)23)18(8-11)15(21)12-6-4-2-1-3-5-10(9-24)14(20)17-12/h10-13,19,24H,1-9H2,(H,17,20)(H,22,23)/t10?,11-,12?,13+/m1/s1
PDB
MMDB

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CHEMBL
PC cid
PC sid
UniChem
PubMed
n/an/a 0.800n/an/an/an/an/an/a



CIBA-GEIGY Corporation

Curated by ChEMBL


Assay Description
Inhibition of NEP 24.11 from rat kidney


J Med Chem 36: 3821-8 (1994)


BindingDB Entry DOI: 10.7270/Q2ZS2X5D
More data for this
Ligand-Target Pair