Glycoside
GD025710
Name:
NoneFormula:
C20H25O4N5Smiles:
OC[C@@H]1O[C@H](n2cnc3c(NCCCCc4ccccc4)ncnc32)[C@H](O)[C@H]1OAglycone:
C1=Nc2c(ncnc2NCCCCc2ccccc2)[N]1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.45 |
| AlogP: | 0.87 | Num_rotatable_bonds: | 8 |
| MolWt: | 399.45 | Num_heavy_atoms: | 29 |
| TPSA: | 125.55 | 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 |
