Glycoside
GD061924
Name:
NoneFormula:
C16H21O4N5Smiles:
C#C[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C(C)CAglycone:
C#CC(Nc1ncnc2c1N=C[N]2)C(C)CSugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.56 |
| AlogP: | -0.49 | Num_rotatable_bonds: | 5 |
| MolWt: | 347.38 | Num_heavy_atoms: | 25 |
| TPSA: | 125.55 | NumAromaticRings: | 2 |
Unique Aglycone
AD30265
Formula: C11H12N5
Smiles:
C#CC(Nc1ncnc2c1N=C[N]2)C(C)C| HBA: | 5 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.36 |
| AlogP: | 1.46 | Num_rotatable_bonds: | 3 |
| MolWt: | 214.25 | Num_heavy_atoms: | 16 |
| TPSA: | 64.27 | NumAromaticRings: | 1 |
