Glycoside
GD091857
Name:
NoneFormula:
C22H26O5N4Smiles:
CN(C)c1ccc(-c2nc(N[C@H]3[C@@H](O)O[C@H](CO)[C@@H](O)[C@@H]3O)c3ccccc3n2)cc1Aglycone:
CN(C)c1ccc(-c2nc(N)c3ccccc3n2)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.36 |
| AlogP: | 0.57 | Num_rotatable_bonds: | 5 |
| MolWt: | 426.47 | Num_heavy_atoms: | 31 |
| TPSA: | 131.2 | NumAromaticRings: | 3 |
Unique Aglycone
AD40059
Formula: C16H16N4
Smiles:
CN(C)c1ccc(-c2nc(N)c3ccccc3n2)cc1| HBA: | 4 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.12 |
| AlogP: | 2.95 | Num_rotatable_bonds: | 2 |
| MolWt: | 264.33 | Num_heavy_atoms: | 20 |
| TPSA: | 55.04 | NumAromaticRings: | 3 |
