Glycoside
GD015003
Name:
NoneFormula:
C19H23O5N5Smiles:
C[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@H](O)[C@H]1O)[C@H](O)c1ccccc1Aglycone:
CC(Nc1ncnc2c1N=C[N]2)C(O)c1ccccc1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.42 |
| AlogP: | -0.03 | Num_rotatable_bonds: | 6 |
| MolWt: | 401.42 | Num_heavy_atoms: | 29 |
| TPSA: | 145.78 | NumAromaticRings: | 3 |
Unique Aglycone
AD03330
Formula: C14H14ON5
Smiles:
CC(Nc1ncnc2c1N=C[N]2)C(O)c1ccccc1| HBA: | 6 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.21 |
| AlogP: | 1.92 | Num_rotatable_bonds: | 4 |
| MolWt: | 268.3 | Num_heavy_atoms: | 20 |
| TPSA: | 84.5 | NumAromaticRings: | 2 |
