Glycoside
GD035948
Name:
NoneFormula:
C12H15O4N5Smiles:
C=Cc1nn([C@@H]2O[C@H](CO)[C@H](O)[C@H]2O)c2ncnc(N)c12Aglycone:
C=CC1=N[N]c2ncnc(N)c21Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.42 |
| AlogP: | -1.34 | Num_rotatable_bonds: | 3 |
| MolWt: | 293.28 | Num_heavy_atoms: | 21 |
| TPSA: | 139.54 | NumAromaticRings: | 2 |
Unique Aglycone
AD22420
Formula: C7H6N5
Smiles:
C=CC1=N[N]c2ncnc(N)c21| HBA: | 5 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 0.2 | Num_rotatable_bonds: | 1 |
| MolWt: | 160.16 | Num_heavy_atoms: | 12 |
| TPSA: | 78.26 | NumAromaticRings: | 1 |
