Glycoside
GD021080
Name:
NoneFormula:
C14H19O4N5Smiles:
C[C@]1(O)C(n2cnc3c(NC4CC4)ncnc32)O[C@H](CO)[C@H]1OAglycone:
C1=Nc2c(ncnc2NC2CC2)[N]1Sugarmoiety:
CC1(O)C(O)OC(CO)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.64 |
| AlogP: | -0.6 | Num_rotatable_bonds: | 4 |
| MolWt: | 321.34 | Num_heavy_atoms: | 23 |
| TPSA: | 125.55 | NumAromaticRings: | 2 |
Unique Aglycone
AD01818
Formula: C8H8N5
Smiles:
C1=Nc2c(ncnc2NC2CC2)[N]1| HBA: | 5 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.38 |
| AlogP: | 0.96 | Num_rotatable_bonds: | 2 |
| MolWt: | 174.19 | Num_heavy_atoms: | 13 |
| TPSA: | 64.27 | NumAromaticRings: | 1 |
