Aglycone
AD59358
Formula: C11H11O4N
Smiles:
C=CC1C(O)OC=C2C(=O)OC(C#N)CC21| HBA: | 5 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.45 |
| AlogP: | 0.48 | Num_rotatable_bonds: | 1 |
| MolWt: | 221.21 | Num_heavy_atoms: | 16 |
| TPSA: | 79.55 | NumAromaticRings: | 0 |