Glycoside
GD078779
Name:
NoneFormula:
C19H18O5N3ClSmiles:
OC[C@H]1O[C@H](O)[C@H](Nc2nc3c(ccc4ccccc43)nc2Cl)[C@@H](O)[C@@H]1OAglycone:
Nc1nc2c(ccc3ccccc32)nc1ClSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.33 |
| AlogP: | 0.65 | Num_rotatable_bonds: | 3 |
| MolWt: | 391.81 | Num_heavy_atoms: | 27 |
| TPSA: | 127.96 | NumAromaticRings: | 3 |
Unique Aglycone
AD36208
Formula: C13H8N3Cl
Smiles:
Nc1nc2c(ccc3ccccc32)nc1Cl| HBA: | 3 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 3.02 | Num_rotatable_bonds: | 0 |
| MolWt: | 229.67 | Num_heavy_atoms: | 16 |
| TPSA: | 51.8 | NumAromaticRings: | 3 |
