Glycoside
GD002785
Name:
NoneFormula:
C19H19O5N5Smiles:
Nc1nc(C#C[C@H](O)c2ccccc2)nc2c1ncn2[C@@H]1O[C@H](CO)[C@H](O)[C@H]1OAglycone:
Nc1nc(C#CC(O)c2ccccc2)nc2c1N=C[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 6 | FractionCSP3: | 0.32 |
| AlogP: | -0.89 | Num_rotatable_bonds: | 3 |
| MolWt: | 397.39 | Num_heavy_atoms: | 29 |
| TPSA: | 159.77 | NumAromaticRings: | 3 |
Unique Aglycone
AD02617
Formula: C14H10ON5
Smiles:
Nc1nc(C#CC(O)c2ccccc2)nc2c1N=C[N]2| HBA: | 6 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.07 |
| AlogP: | 1.05 | Num_rotatable_bonds: | 1 |
| MolWt: | 264.27 | Num_heavy_atoms: | 20 |
| TPSA: | 98.49 | NumAromaticRings: | 2 |
