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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 = 50079520   
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))
BDBM50079520
PNG
((2S)-6-amino-2-[((2S)-2-amino-5-{[(E)-imino(nitroa...)
Show SMILES NCCCC[C@H](NC(=O)[C@@H](N)CCCNC(=N)N[N+]([O-])=O)C(N)=O
Show InChI InChI=1S/C12H26N8O4/c13-6-2-1-5-9(10(15)21)18-11(22)8(14)4-3-7-17-12(16)19-20(23)24/h8-9H,1-7,13-14H2,(H2,15,21)(H,18,22)(H3,16,17,19)/t8-,9-/m0/s1
PDB
MMDB

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PC sid
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Similars

Article
PubMed
450n/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