Glycoside
GD102611
Name:
NoneFormula:
C24H26O6N4Smiles:
C[C@@H]1O[C@@H](OCCNC(=O)c2cc(-c3ccccn3)nc(-c3ccccn3)c2)[C@@H](O)[C@H](O)[C@@H]1OAglycone:
O=C(NCCO)c1cc(-c2ccccn2)nc(-c2ccccn2)c1Sugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.33 |
| AlogP: | 0.78 | Num_rotatable_bonds: | 7 |
| MolWt: | 466.49 | Num_heavy_atoms: | 34 |
| TPSA: | 146.92 | NumAromaticRings: | 3 |
Unique Aglycone
AD43439
Formula: C18H16O2N4
Smiles:
O=C(NCCO)c1cc(-c2ccccn2)nc(-c2ccccn2)c1| HBA: | 6 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.11 |
| AlogP: | 1.93 | Num_rotatable_bonds: | 5 |
| MolWt: | 320.35 | Num_heavy_atoms: | 24 |
| TPSA: | 88.0 | NumAromaticRings: | 3 |
