Glycoside
GD070310
Name:
NoneFormula:
C18H19O4N5Smiles:
OC[C@H]1O[C@@H](n2cnc3c(N/C=C/c4ccccc4)ncnc32)[C@@H](O)[C@@H]1OAglycone:
C(=Cc1ccccc1)Nc1ncnc2c1N=C[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.28 |
| AlogP: | 0.52 | Num_rotatable_bonds: | 5 |
| MolWt: | 369.38 | Num_heavy_atoms: | 27 |
| TPSA: | 125.55 | NumAromaticRings: | 3 |
Unique Aglycone
AD33304
Formula: C13H10N5
Smiles:
C(=Cc1ccccc1)Nc1ncnc2c1N=C[N]2| HBA: | 5 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.0 |
| AlogP: | 2.47 | Num_rotatable_bonds: | 3 |
| MolWt: | 236.26 | Num_heavy_atoms: | 18 |
| TPSA: | 64.27 | NumAromaticRings: | 2 |
