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BDBM50108561 4-(2-Amino-5-methoxy-phenyl)-2-butyrylamino-4-oxo-butyric acid::CHEMBL421175

SMILES: CCCC(=O)NC(CC(=O)c1cc(OC)ccc1N)C(O)=O

InChI Key: InChIKey=PGIKZSXORYBZMW-UHFFFAOYNA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50108561   
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
Nitric-oxide synthase, brain


(Rattus norvegicus (rat))
BDBM50108561
PNG
(4-(2-Amino-5-methoxy-phenyl)-2-butyrylamino-4-oxo-...)
Show SMILES CCCC(=O)NC(CC(=O)c1cc(OC)ccc1N)C(O)=O
Show InChI InChI=1/C15H20N2O5/c1-3-4-14(19)17-12(15(20)21)8-13(18)10-7-9(22-2)5-6-11(10)16/h5-7,12H,3-4,8,16H2,1-2H3,(H,17,19)(H,20,21)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a>1.00E+6n/an/an/an/an/an/a



Universidad de Granada

Curated by ChEMBL


Assay Description
50% inhibitory concentration against Neuronal nitric oxide synthase (nNOS) activity


J Med Chem 45: 263-74 (2002)


Article DOI: 10.1021/jm010916w
BindingDB Entry DOI: 10.7270/Q2474966
More data for this
Ligand-Target Pair