BDBM22750 1-(2,4-dinitrophenyl)-2-phenylethane-1,2-dione::Benzil-based compound, 28

SMILES [O-][N+](=O)c1ccc(C(=O)C(=O)c2ccccc2)c(c1)[N+]([O-])=O

InChI Key InChIKey=PEQXAMVWTHOPJH-UHFFFAOYSA-N

Data  5 KI

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 5 hits for monomerid = 22750   

TargetCoagulation factor XII(Human)
University of Mississippi

LigandPNGBDBM22750(1-(2,4-dinitrophenyl)-2-phenylethane-1,2-dione | B...)
Affinity DataKi:  209nM ΔG°:  -9.11kcal/molepH: 7.4 T: 25°CAssay Description:CE inhibition was determined using a spectrophotometric multiwell plate assay with o-NPA as a substrate. The rate of change in absorbance at 420 nm w...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetLiver carboxylesterase 1(Rabbit)
University of Mississippi

LigandPNGBDBM22750(1-(2,4-dinitrophenyl)-2-phenylethane-1,2-dione | B...)
Affinity DataKi:  520nMAssay Description:CE inhibition was determined using a spectrophotometric multiwell plate assay with o-NPA as a substrate. The rate of change in absorbance at 420 nm w...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCholinesterase(Human)
University of Mississippi

LigandPNGBDBM22750(1-(2,4-dinitrophenyl)-2-phenylethane-1,2-dione | B...)
Affinity DataKi: >1.00E+5nMAssay Description:The cholinesterase assays were performed using colorimetric method reported by Ellman. Estimates of the competitive inhibition constants (Ki) were ob...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetAcetylcholinesterase(Human)
University of Mississippi

LigandPNGBDBM22750(1-(2,4-dinitrophenyl)-2-phenylethane-1,2-dione | B...)
Affinity DataKi: >1.00E+5nMAssay Description:The cholinesterase assays were performed using colorimetric method reported by Ellman. Estimates of the competitive inhibition constants (Ki) were ob...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetLiver carboxylesterase 1(Human)
University of Mississippi

LigandPNGBDBM22750(1-(2,4-dinitrophenyl)-2-phenylethane-1,2-dione | B...)
Affinity DataKi: >1.00E+5nMAssay Description:CE inhibition was determined using a spectrophotometric multiwell plate assay with o-NPA as a substrate. The rate of change in absorbance at 420 nm w...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed