Glycoside
GD078838
Name:
NoneFormula:
C19H19O5N5Smiles:
N#CCOc1ccc(Nc2ncnc3c2ccn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)cc1Aglycone:
N#CCOc1ccc(Nc2ncnc3c2C=C[N]3)cc1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.32 |
| AlogP: | 0.69 | Num_rotatable_bonds: | 6 |
| MolWt: | 397.39 | Num_heavy_atoms: | 29 |
| TPSA: | 145.68 | NumAromaticRings: | 3 |
Unique Aglycone
AD36222
Formula: C14H10ON5
Smiles:
N#CCOc1ccc(Nc2ncnc3c2C=C[N]3)cc1| HBA: | 6 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.07 |
| AlogP: | 2.34 | Num_rotatable_bonds: | 4 |
| MolWt: | 264.27 | Num_heavy_atoms: | 20 |
| TPSA: | 84.93 | NumAromaticRings: | 2 |
