Glycoside
GD026965
Name:
NoneFormula:
C25H23O4N5Smiles:
OC[C@@H]1OC(n2cnc3c(NCc4c5ccccc5cc5ccccc45)ncnc32)[C@H](O)[C@H]1OAglycone:
C1=Nc2c(ncnc2NCc2c3ccccc3cc3ccccc23)[N]1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 6 |
| HBD: | 4 | FractionCSP3: | 0.24 |
| AlogP: | 2.36 | Num_rotatable_bonds: | 5 |
| MolWt: | 457.49 | Num_heavy_atoms: | 34 |
| TPSA: | 125.55 | NumAromaticRings: | 5 |
Unique Aglycone
AD17750
Formula: C20H14N5
Smiles:
C1=Nc2c(ncnc2NCc2c3ccccc3cc3ccccc23)[N]1| HBA: | 5 | RingCount: | 5 |
| HBD: | 1 | FractionCSP3: | 0.05 |
| AlogP: | 4.3 | Num_rotatable_bonds: | 3 |
| MolWt: | 324.37 | Num_heavy_atoms: | 25 |
| TPSA: | 64.27 | NumAromaticRings: | 4 |
