Glycoside
GD013630
Name:
NoneFormula:
C13H12O4N4Cl2Smiles:
Nc1ncnc2c1c(Cl)c(Cl)n2C1O[C@H](CO)[C@H](O)[C@H]1OAglycone:
Nc1ncnc2c1C(Cl)=C(Cl)[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.45 |
| AlogP: | -0.07 | Num_rotatable_bonds: | 2 |
| MolWt: | 335.15 | Num_heavy_atoms: | 21 |
| TPSA: | 126.65 | NumAromaticRings: | 2 |
Unique Aglycone
AD10137
Formula: C8H3N4Cl2
Smiles:
Nc1ncnc2c1C(Cl)=C(Cl)[N]2| HBA: | 4 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 1.41 | Num_rotatable_bonds: | 0 |
| MolWt: | 202.02 | Num_heavy_atoms: | 12 |
| TPSA: | 65.9 | NumAromaticRings: | 1 |
