Glycoside
GD011934
Name:
NoneFormula:
C17H18O4N4Smiles:
Cc1ccc(-c2ncnc3c2ncn3C2O[C@H](CO)[C@H](O)[C@H]2O)cc1Aglycone:
Cc1ccc(-c2ncnc3c2N=C[N]3)cc1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 4 |
| HBD: | 3 | FractionCSP3: | 0.35 |
| AlogP: | 0.41 | Num_rotatable_bonds: | 3 |
| MolWt: | 342.36 | Num_heavy_atoms: | 25 |
| TPSA: | 113.52 | NumAromaticRings: | 3 |
Unique Aglycone
AD09041
Formula: C12H9N4
Smiles:
Cc1ccc(-c2ncnc3c2N=C[N]3)cc1| HBA: | 4 | RingCount: | 3 |
| HBD: | 0 | FractionCSP3: | 0.08 |
| AlogP: | 2.36 | Num_rotatable_bonds: | 1 |
| MolWt: | 209.23 | Num_heavy_atoms: | 16 |
| TPSA: | 52.24 | NumAromaticRings: | 2 |
