Glycoside
GD001488
Name:
NoneFormula:
C17H18O3N4Smiles:
C[C@@H]1O[C@H](n2cc(-c3ccccc3)c3c(N)ncnc32)[C@H](O)[C@H]1OAglycone:
Nc1ncnc2c1C(c1ccccc1)=C[N]2Sugarmoiety:
CC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.29 |
| AlogP: | 1.32 | Num_rotatable_bonds: | 2 |
| MolWt: | 326.36 | Num_heavy_atoms: | 24 |
| TPSA: | 106.42 | NumAromaticRings: | 3 |
Unique Aglycone
AD01487
Formula: C12H9N4
Smiles:
Nc1ncnc2c1C(c1ccccc1)=C[N]2| HBA: | 4 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 1.7 | Num_rotatable_bonds: | 1 |
| MolWt: | 209.23 | Num_heavy_atoms: | 16 |
| TPSA: | 65.9 | NumAromaticRings: | 2 |
