null

SMILES CN(C)CCCc1cncc(CCc2cc(C)cc(N)n2)c1

InChI Key InChIKey=TUAXAWZDVAYXFN-UHFFFAOYSA-N

PDB links: 4 PDB IDs match this monomer.

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Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 190668   

TargetNitric oxide synthase, brain(Rattus norvegicus (rat))
University of California , Irvine

LigandPNGBDBM190668(US10759791, Compound 14k | nNOS inhibitor, 6)copy SMILEScopy InChI
Affinity DataKi:  25.2nM ΔG°:  -10.8kcal/molepH: 7.4 T: 2°CAssay Description:The assay was performed at 37 °C in HEPES buffer (100 mM, with 10% glycerol, pH 7.4) in the presence of 10 uM L-arginine. Also included were 100 ...More data for this Ligand-Target Pair
TargetNitric oxide synthase, brain [D597N](Rattus norvegicus (rat))
University of California , Irvine

LigandPNGBDBM190668(US10759791, Compound 14k | nNOS inhibitor, 6)copy SMILEScopy InChI
Affinity DataKi:  97.5nM ΔG°:  -9.94kcal/molepH: 7.4 T: 2°CAssay Description:The assay was performed at 37 °C in HEPES buffer (100 mM, with 10% glycerol, pH 7.4) in the presence of 10 uM L-arginine. Also included were 100 ...More data for this Ligand-Target Pair
TargetIsoform PNNOS of Nitric oxide synthase, brain (PNNOS) -973,I269V,M336V,D597N](Rattus norvegicus (rats))
University of California , Irvine

LigandPNGBDBM190668(US10759791, Compound 14k | nNOS inhibitor, 6)copy SMILEScopy InChI
Affinity DataKi:  108nM ΔG°:  -9.88kcal/molepH: 7.4 T: 2°CAssay Description:The assay was performed at 37 °C in HEPES buffer (100 mM, with 10% glycerol, pH 7.4) in the presence of 10 uM L-arginine. Also included were 100 ...More data for this Ligand-Target Pair