Glycoside
GD056475
Name:
NoneFormula:
C11H12O5N4Cl2Smiles:
OC[C@H]1O[C@@H](O)[C@H](Nc2nnc(Cl)nc2Cl)[C@@H](O)[C@@H]1OAglycone:
Nc1nnc(Cl)nc1ClSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.67 |
| AlogP: | -1.61 | Num_rotatable_bonds: | 3 |
| MolWt: | 327.12 | Num_heavy_atoms: | 20 |
| TPSA: | 140.85 | NumAromaticRings: | 1 |
Unique Aglycone
AD28385
Formula: C5H2N4Cl2
Smiles:
Nc1nnc(Cl)nc1Cl| HBA: | 4 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 0.76 | Num_rotatable_bonds: | 0 |
| MolWt: | 164.98 | Num_heavy_atoms: | 9 |
| TPSA: | 64.69 | NumAromaticRings: | 1 |
