Glycoside
GD089490
Name:
NoneFormula:
C22H29O4N6Smiles:
C[N@H+]1CCN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C[C@@H]1Cc1ccccc1Aglycone:
C[NH+]1CCN(c2ncnc3c2N=C[N]3)CC1Cc1ccccc1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 5 |
| HBD: | 4 | FractionCSP3: | 0.5 |
| AlogP: | -1.62 | Num_rotatable_bonds: | 5 |
| MolWt: | 441.51 | Num_heavy_atoms: | 32 |
| TPSA: | 121.2 | NumAromaticRings: | 3 |
Unique Aglycone
AD39039
Formula: C17H20N6
Smiles:
C[NH+]1CCN(c2ncnc3c2N=C[N]3)CC1Cc1ccccc1| HBA: | 6 | RingCount: | 4 |
| HBD: | 1 | FractionCSP3: | 0.35 |
| AlogP: | 0.33 | Num_rotatable_bonds: | 3 |
| MolWt: | 308.39 | Num_heavy_atoms: | 23 |
| TPSA: | 59.92 | NumAromaticRings: | 2 |
