Glycoside
GD082929
Name:
NoneFormula:
C18H19O6N5Smiles:
COc1ccc(C(=O)Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@H](O)[C@H]2O)cc1Aglycone:
COc1ccc(C(=O)Nc2ncnc3c2N=C[N]3)cc1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.33 |
| AlogP: | -0.3 | Num_rotatable_bonds: | 5 |
| MolWt: | 401.38 | Num_heavy_atoms: | 29 |
| TPSA: | 151.85 | NumAromaticRings: | 3 |
Unique Aglycone
AD03682
Formula: C13H10O2N5
Smiles:
COc1ccc(C(=O)Nc2ncnc3c2N=C[N]3)cc1| HBA: | 7 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.08 |
| AlogP: | 1.65 | Num_rotatable_bonds: | 3 |
| MolWt: | 268.26 | Num_heavy_atoms: | 20 |
| TPSA: | 90.57 | NumAromaticRings: | 2 |
