Glycoside
GD103669
Name:
NoneFormula:
C19H17O4N7Cl2Smiles:
Nc1ncnc2c1nc(N/N=C/c1c(Cl)cccc1Cl)n2[C@H]1O[C@@H](CO)[C@H](O)[C@@H]1OAglycone:
Nc1ncnc2c1N=C(NN=Cc1c(Cl)cccc1Cl)[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 6 | FractionCSP3: | 0.29 |
| AlogP: | 0.77 | Num_rotatable_bonds: | 5 |
| MolWt: | 454.27 | Num_heavy_atoms: | 30 |
| TPSA: | 163.93 | NumAromaticRings: | 3 |
Unique Aglycone
AD43857
Formula: C14H8N7Cl2
Smiles:
Nc1ncnc2c1N=C(NN=Cc1c(Cl)cccc1Cl)[N]2| HBA: | 7 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.0 |
| AlogP: | 2.23 | Num_rotatable_bonds: | 2 |
| MolWt: | 321.15 | Num_heavy_atoms: | 21 |
| TPSA: | 102.65 | NumAromaticRings: | 2 |
