Glycoside
GD081607
Name:
NoneFormula:
C19H26O6N4Smiles:
CCn1c(N2CCN(C(=O)C(=O)[C@H](O)[C@@H](O)[C@H](O)CO)CC2)nc2ccccc21Aglycone:
CCn1c(N2CCNCC2)nc2ccccc21Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.53 |
| AlogP: | -1.65 | Num_rotatable_bonds: | 7 |
| MolWt: | 406.44 | Num_heavy_atoms: | 29 |
| TPSA: | 139.36 | NumAromaticRings: | 2 |
Unique Aglycone
AD36719
Formula: C13H18N4
Smiles:
CCn1c(N2CCNCC2)nc2ccccc21| HBA: | 4 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.46 |
| AlogP: | 1.47 | Num_rotatable_bonds: | 2 |
| MolWt: | 230.32 | Num_heavy_atoms: | 17 |
| TPSA: | 33.09 | NumAromaticRings: | 2 |
