Glycoside
GD065823
Name:
NoneFormula:
C14H14O6N5ClSmiles:
O=C(Nc1cnc(-n2nccn2)c(Cl)c1)C(=O)[C@H](O)[C@@H](O)[C@H](O)COAglycone:
Nc1cnc(-n2nccn2)c(Cl)c1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 11 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.31 |
| AlogP: | -2.1 | Num_rotatable_bonds: | 7 |
| MolWt: | 371.74 | Num_heavy_atoms: | 25 |
| TPSA: | 170.69 | NumAromaticRings: | 2 |
Unique Aglycone
AD31646
Formula: C8H6N5Cl
Smiles:
Nc1cnc(-n2nccn2)c(Cl)c1| HBA: | 5 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 0.9 | Num_rotatable_bonds: | 1 |
| MolWt: | 195.61 | Num_heavy_atoms: | 13 |
| TPSA: | 69.62 | NumAromaticRings: | 2 |
