Glycoside
GD070524
Name:
NoneFormula:
C18H22O4N5Smiles:
[NH3+]Cc1ccc(Nc2ncnc3c2ccn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)cc1Aglycone:
[NH3+]Cc1ccc(Nc2ncnc3c2C=C[N]3)cc1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 4 |
| HBD: | 7 | FractionCSP3: | 0.33 |
| AlogP: | -0.47 | Num_rotatable_bonds: | 5 |
| MolWt: | 372.41 | Num_heavy_atoms: | 27 |
| TPSA: | 140.3 | NumAromaticRings: | 3 |
Unique Aglycone
AD33433
Formula: C13H13N5
Smiles:
[NH3+]Cc1ccc(Nc2ncnc3c2C=C[N]3)cc1| HBA: | 5 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.08 |
| AlogP: | 1.18 | Num_rotatable_bonds: | 3 |
| MolWt: | 239.28 | Num_heavy_atoms: | 18 |
| TPSA: | 79.55 | NumAromaticRings: | 2 |
