Properties
HBA: | 9 | RingCount: | 1 |
HBD: | 4 | FractionCSP3: | 0.83 |
AlogP: | -1.93 | Num_rotatable_bonds: | 6 |
MolWt: | 307.3 | Num_heavy_atoms: | 21 |
TPSA: | 134.55 | NumAromaticRings: | 0 |
Unique Aglycone
AD00056
Formula: C3H6O3
Smiles:
CC(O)C(=O)OHBA: | 3 | RingCount: | 0 |
HBD: | 2 | FractionCSP3: | 0.67 |
AlogP: | -0.55 | Num_rotatable_bonds: | 1 |
MolWt: | 90.08 | Num_heavy_atoms: | 6 |
TPSA: | 57.53 | NumAromaticRings: | 0 |