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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Nitric Oxide Synthase, brain' and Monomerid = 50090929   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Nitric oxide synthase, brain


(Homo sapiens (Human))
BDBM50090929
PNG
(CHEMBL420637 | L-Arg NO2-L-Dbu-OH)
Show SMILES NCC[C@H](NC(=O)[C@@H](N)CCCNC(=N)N[N+]([O-])=O)C(O)=O
Show InChI InChI=1S/C10H21N7O5/c11-4-3-7(9(19)20)15-8(18)6(12)2-1-5-14-10(13)16-17(21)22/h6-7H,1-5,11-12H2,(H,15,18)(H,19,20)(H3,13,14,16)/t6-,7-/m0/s1
PDB
MMDB

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Similars

Article
PubMed
2.84E+4n/an/an/an/an/an/an/an/a



Northwestern University

Curated by ChEMBL


Assay Description
Binding affinity against bovine brain nNOS (neuronal).


J Med Chem 43: 2938-45 (2000)


Article DOI: 10.1021/jm000127z
BindingDB Entry DOI: 10.7270/Q2NG4RBF
More data for this
Ligand-Target Pair