Glycoside
GD042908
Name:
2-(hydroxymethyl)-6-[(pyridin-2-yl)amino]oxane-3,4,5-triolFormula:
C11H16O5N2Smiles:
OC[C@@H]1O[C@H](Nc2ccccn2)[C@H](O)[C@H](O)[C@H]1OAglycone:
Nc1ccccn1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.55 |
| AlogP: | -1.71 | Num_rotatable_bonds: | 3 |
| MolWt: | 256.26 | Num_heavy_atoms: | 18 |
| TPSA: | 115.07 | NumAromaticRings: | 1 |
Unique Aglycone
AD24880
Formula: C5H6N2
Smiles:
Nc1ccccn1| HBA: | 2 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 0.66 | Num_rotatable_bonds: | 0 |
| MolWt: | 94.12 | Num_heavy_atoms: | 7 |
| TPSA: | 38.91 | NumAromaticRings: | 1 |
