BDBM36173 1-butanol::1-butanol-d10::CHEMBL14245
SMILES CCCCO
InChI Key InChIKey=LRHPLDYGYMQRHN-UHFFFAOYSA-N
Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB
Found 1 hit for monomerid = 36173
Affinity DataKi: 4.70E+7nMAssay Description:Compound was evaluated for reversible inhibition of hydrolysis acetylcholine by acetylcholinesterase and represented as KI(com)More data for this Ligand-Target Pair
Activity Spreadsheet -- ITC Data from BindingDB
Found 6 hits for monomerid = 36173
ITC DataΔG°: -2.59kcal/mole −TΔS°: 0.0214kcal/mole ΔH°: -2.60kcal/mole logk: 79.5
pH: 6.9 T: 25.00°C
pH: 6.9 T: 25.00°C
ITC DataΔG°: -2.62kcal/mole −TΔS°: -0.0641kcal/mole ΔH°: -2.56kcal/mole logk: 83.8
pH: 6.9 T: 25.00°C
pH: 6.9 T: 25.00°C
ITC DataΔG°: -2.54kcal/mole −TΔS°: 0.0427kcal/mole ΔH°: -2.58kcal/mole logk: 73
pH: 6.9 T: 25.00°C
pH: 6.9 T: 25.00°C
ITC DataΔG°: -2.59kcal/mole −TΔS°: -0.150kcal/mole ΔH°: -2.44kcal/mole logk: 79
pH: 6.9 T: 25.00°C
pH: 6.9 T: 25.00°C
ITC DataΔG°: -1.65kcal/mole −TΔS°: -2.67kcal/mole ΔH°: 1.03kcal/mole logk: 16
pH: 6.9 T: 25.00°C
pH: 6.9 T: 25.00°C
ITC DataΔG°: -2.60kcal/mole −TΔS°: 0.214kcal/mole ΔH°: -2.77kcal/mole logk: 79.7
pH: 6.9 T: 25.00°C
pH: 6.9 T: 25.00°C