Glycoside
GD026948
Name:
NoneFormula:
C17H19O4N6ISmiles:
Nc1ccc(CNc2ncnc3c2ncn3C2O[C@H](CO)[C@H](O)[C@H]2O)cc1IAglycone:
Nc1ccc(CNc2ncnc3c2N=C[N]3)cc1ISugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 6 | FractionCSP3: | 0.35 |
| AlogP: | 0.24 | Num_rotatable_bonds: | 5 |
| MolWt: | 498.28 | Num_heavy_atoms: | 28 |
| TPSA: | 151.57 | NumAromaticRings: | 3 |
Unique Aglycone
AD02740
Formula: C12H10N6I
Smiles:
Nc1ccc(CNc2ncnc3c2N=C[N]3)cc1I| HBA: | 6 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.08 |
| AlogP: | 2.18 | Num_rotatable_bonds: | 3 |
| MolWt: | 365.16 | Num_heavy_atoms: | 19 |
| TPSA: | 90.29 | NumAromaticRings: | 2 |
