Glycoside
GD047930
Name:
NoneFormula:
C14H18O5N4Smiles:
OC[C@H]1O[C@H](O)[C@H](Nc2ccc(-n3ccnc3)nc2)[C@@H](O)[C@@H]1OAglycone:
Nc1ccc(-n2ccnc2)nc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.43 |
| AlogP: | -1.52 | Num_rotatable_bonds: | 4 |
| MolWt: | 322.32 | Num_heavy_atoms: | 23 |
| TPSA: | 132.89 | NumAromaticRings: | 2 |
Unique Aglycone
AD25734
Formula: C8H8N4
Smiles:
Nc1ccc(-n2ccnc2)nc1| HBA: | 4 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 0.85 | Num_rotatable_bonds: | 1 |
| MolWt: | 160.18 | Num_heavy_atoms: | 12 |
| TPSA: | 56.73 | NumAromaticRings: | 2 |
