Glycoside
GD091869
Name:
NoneFormula:
C20H25O6N5Smiles:
COc1ccccc1OCCN(C)c1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1OAglycone:
COc1ccccc1OCCN(C)c1ncnc2c1N=C[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 3 | FractionCSP3: | 0.45 |
| AlogP: | -0.04 | Num_rotatable_bonds: | 8 |
| MolWt: | 431.45 | Num_heavy_atoms: | 31 |
| TPSA: | 135.22 | NumAromaticRings: | 3 |
Unique Aglycone
AD40065
Formula: C15H16O2N5
Smiles:
COc1ccccc1OCCN(C)c1ncnc2c1N=C[N]2| HBA: | 7 | RingCount: | 3 |
| HBD: | 0 | FractionCSP3: | 0.27 |
| AlogP: | 1.91 | Num_rotatable_bonds: | 6 |
| MolWt: | 298.33 | Num_heavy_atoms: | 22 |
| TPSA: | 73.94 | NumAromaticRings: | 2 |
