Glycoside
GD056582
Name:
NoneFormula:
C13H15O5N4ClSmiles:
OC[C@H]1O[C@@H](O)[C@H](Nc2cc(Cl)cn3ncnc23)[C@@H](O)[C@@H]1OAglycone:
Nc1cc(Cl)cn2ncnc12Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.5 |
| AlogP: | -1.41 | Num_rotatable_bonds: | 3 |
| MolWt: | 330.73 | Num_heavy_atoms: | 22 |
| TPSA: | 132.37 | NumAromaticRings: | 2 |
Unique Aglycone
AD28424
Formula: C7H5N4Cl
Smiles:
Nc1cc(Cl)cn2ncnc12| HBA: | 4 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 0.96 | Num_rotatable_bonds: | 0 |
| MolWt: | 168.59 | Num_heavy_atoms: | 11 |
| TPSA: | 56.21 | NumAromaticRings: | 2 |
