Compound: Amigdalin
SMILES: OCC3OC(OCC2OC(OC(C#N)c1ccccc1)C(O)C(O)C2O)C(O)C(O)C3O 
Molecular weight: 457.4320000000001
Number of H-bond donors: 7
Number of rings: 3
Number of rotatable bonds: 7
Polar surface area: 202.31999999999996
Minimum degree: 1
ESOL predicted log solubility (mol/L): -0.9740000000000001
Measured log solubility (mol/L): -0.77