Aglycone

AD58082
Formula: C9H13O4N
Smiles:
COC1CC(O)C(=CC#N)C(O)C1OHBA: | 5 | RingCount: | 1 |
HBD: | 3 | FractionCSP3: | 0.67 |
AlogP: | -1.06 | Num_rotatable_bonds: | 1 |
MolWt: | 199.21 | Num_heavy_atoms: | 14 |
TPSA: | 93.71 | NumAromaticRings: | 0 |
HBA: | 5 | RingCount: | 1 |
HBD: | 3 | FractionCSP3: | 0.67 |
AlogP: | -1.06 | Num_rotatable_bonds: | 1 |
MolWt: | 199.21 | Num_heavy_atoms: | 14 |
TPSA: | 93.71 | NumAromaticRings: | 0 |