BDBM25881 3-({12-ethyl-8-methyl-9-oxo-2,4,8-triazatricyclo[8.4.0.0^{2,6}]tetradeca-1(14),3,5,10,12-pentaen-5-yl}carbonyloxy)propyl 12-ethyl-8-methyl-9-oxo-2,4,8-triazatricyclo[8.4.0.0^{2,6}]tetradeca-1(10),3,5,11,13-pentaene-5-carboxylate::XLi356, 4

SMILES CCc1ccc-2c(c1)C(=O)N(C)Cc1c(ncn-21)C(=O)OCCCOC(=O)c1ncn-2c1CN(C)C(=O)c1cc(CC)ccc-21

InChI Key InChIKey=AOQOJIJLIFNFFB-UHFFFAOYSA-N

Data  5 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 5 hits for monomerid = 25881   

LigandPNGBDBM25881(3-({12-ethyl-8-methyl-9-oxo-2,4,8-triazatricyclo[8...)
Affinity DataKi:  101nMAssay Description:The affinity of compounds for human recombinant GABA (A) receptors was measured by competition binding using [3H]flunitrazepam. Assays were carried o...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed

LigandPNGBDBM25881(3-({12-ethyl-8-methyl-9-oxo-2,4,8-triazatricyclo[8...)
Affinity DataKi:  1.85E+3nM ΔG°:  -7.26kcal/molepH: 7.4 T: 4°CAssay Description:The affinity of compounds for human recombinant GABA (A) receptors was measured by competition binding using [3H]flunitrazepam. Assays were carried o...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed

LigandPNGBDBM25881(3-({12-ethyl-8-methyl-9-oxo-2,4,8-triazatricyclo[8...)
Affinity DataKi:  4.70E+3nM ΔG°:  -6.75kcal/molepH: 7.4 T: 4°CAssay Description:The affinity of compounds for human recombinant GABA (A) receptors was measured by competition binding using [3H]flunitrazepam. Assays were carried o...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed

LigandPNGBDBM25881(3-({12-ethyl-8-methyl-9-oxo-2,4,8-triazatricyclo[8...)
Affinity DataKi:  5.00E+3nMAssay Description:The affinity of compounds for human recombinant GABA (A) receptors was measured by competition binding using [3H]flunitrazepam. Assays were carried o...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed

LigandPNGBDBM25881(3-({12-ethyl-8-methyl-9-oxo-2,4,8-triazatricyclo[8...)
Affinity DataKi:  8.55E+3nM ΔG°:  -6.42kcal/molepH: 7.4 T: 4°CAssay Description:The affinity of compounds for human recombinant GABA (A) receptors was measured by competition binding using [3H]flunitrazepam. Assays were carried o...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed