Glycoside
GD048956
Name:
NoneFormula:
C12H14O6N4Smiles:
O=C(Nc1ccn2cnnc2c1)C(=O)[C@H](O)[C@H](O)[C@@H](O)COAglycone:
Nc1ccn2cnnc2c1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.33 |
| AlogP: | -2.69 | Num_rotatable_bonds: | 6 |
| MolWt: | 310.27 | Num_heavy_atoms: | 22 |
| TPSA: | 157.28 | NumAromaticRings: | 2 |
Unique Aglycone
AD26001
Formula: C6H6N4
Smiles:
Nc1ccn2cnnc2c1| HBA: | 4 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 0.31 | Num_rotatable_bonds: | 0 |
| MolWt: | 134.14 | Num_heavy_atoms: | 10 |
| TPSA: | 56.21 | NumAromaticRings: | 2 |
