BDBM237233 hCA inhibitor, 4

SMILES CCOC1Oc2c(Br)cc(Br)cc2C(=O)\C1=C/Nc1ccc(cc1)S(N)(=O)=O

InChI Key InChIKey=BMWXCQVVGGWPAJ-NTEUORMPSA-N

Data  3 KI

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 237233   

TargetCarbonic anhydrase 2(Homo sapiens (Human))
Ondokuz Mayis University

LigandPNGBDBM237233(hCA inhibitor, 4)
Affinity DataKi:  1.86E+3nM ΔG°:  -7.81kcal/molepH: 7.4 T: 2°CAssay Description:Carbonic anhydrase activity was assayed by following the change in absorbance at 348 nm of 4-nitrophenylacetate (NPA) to 4-nitrophenylate ion over a ...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails ArticlePubMed
TargetCarbonic anhydrase 6(Homo sapiens (Human))
Ondokuz Mayis University

LigandPNGBDBM237233(hCA inhibitor, 4)
Affinity DataKi:  4.28E+3nM ΔG°:  -7.32kcal/molepH: 7.4 T: 2°CAssay Description:Carbonic anhydrase activity was assayed by following the change in absorbance at 348 nm of 4-nitrophenylacetate (NPA) to 4-nitrophenylate ion over a ...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails ArticlePubMed
TargetCarbonic anhydrase 1(Homo sapiens (Human))
Ondokuz Mayis University

LigandPNGBDBM237233(hCA inhibitor, 4)
Affinity DataKi:  7.12E+4nM ΔG°:  -5.65kcal/molepH: 7.4 T: 2°CAssay Description:Carbonic anhydrase activity was assayed by following the change in absorbance at 348 nm of 4-nitrophenylacetate (NPA) to 4-nitrophenylate ion over a ...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails ArticlePubMed