Glycoside
GD059283
Name:
NoneFormula:
C16H20O4N4Smiles:
O[C@H]1[C@@H](O)[C@@H](O)[C@H](CNc2ccccn2)O[C@H]1Nc1ccccn1Aglycone:
CNc1ccccn1.Nc1ccccn1Sugarmoiety:
OC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.38 |
| AlogP: | -0.19 | Num_rotatable_bonds: | 5 |
| MolWt: | 332.36 | Num_heavy_atoms: | 24 |
| TPSA: | 119.76 | NumAromaticRings: | 2 |
Unique Aglycone
AD24880
Formula: C5H6N2
Smiles:
Nc1ccccn1| HBA: | 2 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 0.66 | Num_rotatable_bonds: | 0 |
| MolWt: | 94.12 | Num_heavy_atoms: | 7 |
| TPSA: | 38.91 | NumAromaticRings: | 1 |
AD29389
Formula: C6H8N2
Smiles:
CNc1ccccn1| HBA: | 2 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.17 |
| AlogP: | 1.12 | Num_rotatable_bonds: | 1 |
| MolWt: | 108.14 | Num_heavy_atoms: | 8 |
| TPSA: | 24.92 | NumAromaticRings: | 1 |
