Glycoside
GD072625
Name:
NoneFormula:
C16H21O6N4ClSmiles:
O=C(NC1CCN(c2ccc(Cl)nn2)CC1)C(=O)[C@H](O)[C@@H](O)[C@@H](O)COAglycone:
NC1CCN(c2ccc(Cl)nn2)CC1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.6 |
| AlogP: | -2.14 | Num_rotatable_bonds: | 7 |
| MolWt: | 388.81 | Num_heavy_atoms: | 26 |
| TPSA: | 156.11 | NumAromaticRings: | 1 |
Unique Aglycone
AD33840
Formula: C10H13N4Cl
Smiles:
NC1CCN(c2ccc(Cl)nn2)CC1| HBA: | 4 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.56 |
| AlogP: | 1.06 | Num_rotatable_bonds: | 1 |
| MolWt: | 212.68 | Num_heavy_atoms: | 14 |
| TPSA: | 55.04 | NumAromaticRings: | 1 |
