Glycoside
GD056026
Name:
NoneFormula:
C14H14O6N3ClSmiles:
O=C(Nc1cn2c(Cl)cccc2n1)C(=O)[C@H](O)[C@H](O)[C@H](O)COAglycone:
Nc1cn2c(Cl)cccc2n1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.31 |
| AlogP: | -1.43 | Num_rotatable_bonds: | 6 |
| MolWt: | 343.72 | Num_heavy_atoms: | 23 |
| TPSA: | 144.39 | NumAromaticRings: | 2 |
Unique Aglycone
AD28190
Formula: C8H6N3Cl
Smiles:
Nc1cn2c(Cl)cccc2n1| HBA: | 3 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 1.57 | Num_rotatable_bonds: | 0 |
| MolWt: | 167.6 | Num_heavy_atoms: | 11 |
| TPSA: | 43.32 | NumAromaticRings: | 2 |
