Glycoside
GD030774
Name:
NoneFormula:
C21H26O4N6Smiles:
CNC(=O)[C@@H]1O[C@H](n2cnc3c(NCCCCc4ccccc4)ncnc32)[C@H](O)[C@H]1OAglycone:
C1=Nc2c(ncnc2NCCCCc2ccccc2)[N]1Sugarmoiety:
CNC(=O)C1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.43 |
| AlogP: | 0.63 | Num_rotatable_bonds: | 8 |
| MolWt: | 426.48 | Num_heavy_atoms: | 31 |
| TPSA: | 134.42 | NumAromaticRings: | 3 |
Unique Aglycone
AD17016
Formula: C15H16N5
Smiles:
C1=Nc2c(ncnc2NCCCCc2ccccc2)[N]1| HBA: | 5 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.27 |
| AlogP: | 2.82 | Num_rotatable_bonds: | 6 |
| MolWt: | 266.33 | Num_heavy_atoms: | 20 |
| TPSA: | 64.27 | NumAromaticRings: | 2 |
