Glycoside
GD033295
Name:
NoneFormula:
C18H21O4N5Smiles:
Nc1ncnc2c1c(CCc1ccccc1)nn2[C@@H]1O[C@H](CO)[C@H](O)[C@H]1OAglycone:
Nc1ncnc2c1C(CCc1ccccc1)=N[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.39 |
| AlogP: | -0.19 | Num_rotatable_bonds: | 5 |
| MolWt: | 371.4 | Num_heavy_atoms: | 27 |
| TPSA: | 139.54 | NumAromaticRings: | 3 |
Unique Aglycone
AD05422
Formula: C13H12N5
Smiles:
Nc1ncnc2c1C(CCc1ccccc1)=N[N]2| HBA: | 5 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.15 |
| AlogP: | 1.65 | Num_rotatable_bonds: | 3 |
| MolWt: | 238.27 | Num_heavy_atoms: | 18 |
| TPSA: | 78.26 | NumAromaticRings: | 2 |
