Glycoside
GD092468
Name:
NoneFormula:
C20H25O6N5Smiles:
COc1ccc(CCNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)cc1OCAglycone:
COc1ccc(CCNc2ncnc3c2N=C[N]3)cc1OCSugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.45 |
| AlogP: | 0.11 | Num_rotatable_bonds: | 8 |
| MolWt: | 431.45 | Num_heavy_atoms: | 31 |
| TPSA: | 144.01 | NumAromaticRings: | 3 |
Unique Aglycone
AD09460
Formula: C15H16O2N5
Smiles:
COc1ccc(CCNc2ncnc3c2N=C[N]3)cc1OC| HBA: | 7 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.27 |
| AlogP: | 2.06 | Num_rotatable_bonds: | 6 |
| MolWt: | 298.33 | Num_heavy_atoms: | 22 |
| TPSA: | 82.73 | NumAromaticRings: | 2 |
