Glycoside
GD031314
Name:
NoneFormula:
C15H19O4N3Smiles:
Cc1c(-c2ccccc2)nnn1C[C@@H]1O[C@H](CO)[C@H](O)[C@H]1OAglycone:
Cc1c(-c2ccccc2)nnn1CSugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.47 |
| AlogP: | -0.26 | Num_rotatable_bonds: | 4 |
| MolWt: | 305.33 | Num_heavy_atoms: | 22 |
| TPSA: | 100.63 | NumAromaticRings: | 2 |
Unique Aglycone
AD20187
Formula: C10H11N3
Smiles:
Cc1c(-c2ccccc2)nnn1C| HBA: | 3 | RingCount: | 2 |
| HBD: | 0 | FractionCSP3: | 0.2 |
| AlogP: | 1.79 | Num_rotatable_bonds: | 1 |
| MolWt: | 173.22 | Num_heavy_atoms: | 13 |
| TPSA: | 30.71 | NumAromaticRings: | 2 |
