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BDBM49480 MLS000569335::SMR000154957::[2-cyano-2-[3-(3,5-dimethyl-1-pyridin-1-iumyl)-2-quinoxalinyl]ethenylidene]azanide::[2-cyano-2-[3-(3,5-dimethylpyridin-1-ium-1-yl)quinoxalin-2-yl]ethenylidene]azanide::cid_2331540

SMILES: Cc1cc(C)c[n+](c1)-c1nc2ccccc2nc1[C-](C#N)C#N

InChI Key: InChIKey=RWVKFLYTLLEGBQ-UHFFFAOYSA-N

Data: 1 EC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 49480   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Nuclear factor NF-kappa-B


(Homo sapiens (Human))
BDBM49480
PNG
(MLS000569335 | SMR000154957 | [2-cyano-2-[3-(3,5-d...)
Show SMILES Cc1cc(C)c[n+](c1)-c1nc2ccccc2nc1[C-](C#N)C#N
Show InChI InChI=1S/C18H13N5/c1-12-7-13(2)11-23(10-12)18-17(14(8-19)9-20)21-15-5-3-4-6-16(15)22-18/h3-7,10-11H,1-2H3
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PCBioAssay
n/an/an/an/a 2.80E+4n/an/an/an/a



SRMLSC

Curated by PubChem BioAssay


Assay Description
Southern Research Molecular Libraries Screening Center (SRMLSC) Southern Research Institute (Birmingham, Alabama) NIH Molecular Libraries Screening C...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q27P8WT7
More data for this
Ligand-Target Pair