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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Nitric Oxide Synthase, endothelial' and Monomerid = 50128921   
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, endothelial


(Homo sapiens (Human))
BDBM50128921
PNG
((3aR,9bS)-8-Chloro-7-[2-(3-chloro-benzylamino)-eth...)
Show SMILES NC1=Nc2cc(CCNCc3cccc(Cl)c3)c(Cl)cc2[C@H]2CCC[C@@H]12
Show InChI InChI=1S/C21H23Cl2N3/c22-15-4-1-3-13(9-15)12-25-8-7-14-10-20-18(11-19(14)23)16-5-2-6-17(16)21(24)26-20/h1,3-4,9-11,16-17,25H,2,5-8,12H2,(H2,24,26)/t16-,17+/m0/s1
PDB

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 8.70E+3n/an/an/an/an/an/a



Schering AG

Curated by ChEMBL


Assay Description
Inhibitory concentration against recombinant human Endothelial nitric oxide synthase


Bioorg Med Chem Lett 13: 1981-4 (2003)


Article DOI: 10.1016/s0960-894x(03)00351-2
BindingDB Entry DOI: 10.7270/Q2FN16QG
More data for this
Ligand-Target Pair