Glycoside
GD024549
Name:
NoneFormula:
C17H20O4N6Smiles:
Nc1ccc(CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@H](O)[C@H]2O)cc1Aglycone:
Nc1ccc(CNc2ncnc3c2N=C[N]3)cc1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 6 | FractionCSP3: | 0.35 |
| AlogP: | -0.37 | Num_rotatable_bonds: | 5 |
| MolWt: | 372.39 | Num_heavy_atoms: | 27 |
| TPSA: | 151.57 | NumAromaticRings: | 3 |
Unique Aglycone
AD01322
Formula: C12H11N6
Smiles:
Nc1ccc(CNc2ncnc3c2N=C[N]3)cc1| HBA: | 6 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.08 |
| AlogP: | 1.58 | Num_rotatable_bonds: | 3 |
| MolWt: | 239.26 | Num_heavy_atoms: | 18 |
| TPSA: | 90.29 | NumAromaticRings: | 2 |
