Glycoside
GD051108
Name:
NoneFormula:
C12H10O4N4Cl2Smiles:
OC[C@H]1O[C@@H](n2cnc3c(Cl)nc(Cl)nc32)[C@@H](O)[C@H]1OAglycone:
Clc1nc(Cl)c2c(n1)[N]C=N2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.5 |
| AlogP: | -0.26 | Num_rotatable_bonds: | 2 |
| MolWt: | 321.12 | Num_heavy_atoms: | 20 |
| TPSA: | 113.52 | NumAromaticRings: | 2 |
Unique Aglycone
AD05729
Formula: C7HN4Cl2
Smiles:
Clc1nc(Cl)c2c(n1)[N]C=N2| HBA: | 4 | RingCount: | 2 |
| HBD: | 0 | FractionCSP3: | 0.0 |
| AlogP: | 1.69 | Num_rotatable_bonds: | 0 |
| MolWt: | 188.0 | Num_heavy_atoms: | 11 |
| TPSA: | 52.24 | NumAromaticRings: | 1 |
