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BDBM90841 1-N,3-N-bis(2,4-dimethoxyphenyl)-5-nitrobenzene-1,3-dicarboxamide::MLS001205060::N,N'-Bis-(2,4-dimethoxy-phenyl)-5-nitro-isophthalamide::N,N'-bis(2,4-dimethoxyphenyl)-5-nitro-isophthalamide::N1,N3-bis(2,4-dimethoxyphenyl)-5-nitro-benzene-1,3-dicarboxamide::N1,N3-bis(2,4-dimethoxyphenyl)-5-nitrobenzene-1,3-dicarboxamide::SMR000516200::cid_1116126

SMILES: COc1ccc(NC(=O)c2cc(cc(c2)[N+]([O-])=O)C(=O)Nc2ccc(OC)cc2OC)c(OC)c1

InChI Key: InChIKey=AKHSJMMJALKRRW-UHFFFAOYSA-N

Data: 1 EC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 90841   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
corticotropin releasing factor-binding protein


(Homo sapiens (Human))
BDBM90841
PNG
(1-N,3-N-bis(2,4-dimethoxyphenyl)-5-nitrobenzene-1,...)
Show SMILES COc1ccc(NC(=O)c2cc(cc(c2)[N+]([O-])=O)C(=O)Nc2ccc(OC)cc2OC)c(OC)c1
Show InChI InChI=1S/C24H23N3O8/c1-32-17-5-7-19(21(12-17)34-3)25-23(28)14-9-15(11-16(10-14)27(30)31)24(29)26-20-8-6-18(33-2)13-22(20)35-4/h5-13H,1-4H3,(H,25,28)(H,26,29)
KEGG

UniProtKB/SwissProt

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PC cid
PC sid
UniChem
Article
PCBioAssay
n/an/an/an/a>5.30E+4n/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2012)


Article DOI: 10.1038/nchembio.2085
BindingDB Entry DOI: 10.7270/Q2VX0F3D
More data for this
Ligand-Target Pair