Glycoside
GD007250
Name:
NoneFormula:
C20H30O4N6Smiles:
OC[C@@H]1O[C@H](n2cnc3c(N4CCN(C5CCCCC5)CC4)ncnc32)[C@H](O)[C@H]1OAglycone:
C1=Nc2c(ncnc2N2CCN(C3CCCCC3)CC2)[N]1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 5 |
| HBD: | 3 | FractionCSP3: | 0.75 |
| AlogP: | -0.11 | Num_rotatable_bonds: | 4 |
| MolWt: | 418.5 | Num_heavy_atoms: | 30 |
| TPSA: | 120.0 | NumAromaticRings: | 2 |
Unique Aglycone
AD05915
Formula: C15H21N6
Smiles:
C1=Nc2c(ncnc2N2CCN(C3CCCCC3)CC2)[N]1| HBA: | 6 | RingCount: | 4 |
| HBD: | 0 | FractionCSP3: | 0.67 |
| AlogP: | 1.84 | Num_rotatable_bonds: | 2 |
| MolWt: | 285.37 | Num_heavy_atoms: | 21 |
| TPSA: | 58.72 | NumAromaticRings: | 1 |
