Glycoside
GD078703
Name:
NoneFormula:
C19H20O4N6Smiles:
OC[C@H]1O[C@@H](n2cnc3c(NCc4cc5ccccc5[nH]4)ncnc32)[C@H](O)[C@@H]1OAglycone:
C1=Nc2c(ncnc2NCc2cc3ccccc3[nH]2)[N]1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 5 |
| HBD: | 5 | FractionCSP3: | 0.32 |
| AlogP: | 0.53 | Num_rotatable_bonds: | 5 |
| MolWt: | 396.41 | Num_heavy_atoms: | 29 |
| TPSA: | 141.34 | NumAromaticRings: | 4 |
Unique Aglycone
AD36172
Formula: C14H11N6
Smiles:
C1=Nc2c(ncnc2NCc2cc3ccccc3[nH]2)[N]1| HBA: | 6 | RingCount: | 4 |
| HBD: | 2 | FractionCSP3: | 0.07 |
| AlogP: | 2.48 | Num_rotatable_bonds: | 3 |
| MolWt: | 263.28 | Num_heavy_atoms: | 20 |
| TPSA: | 80.06 | NumAromaticRings: | 3 |
