Glycoside
GD095509
Name:
NoneFormula:
C18H25O5N6FSSmiles:
OC[C@H]1O[C@@H](n2cc(F)c3c(NC(=S)NCCN4CCOCC4)ncnc32)[C@H](O)[C@@H]1OAglycone:
FC1=C[N]c2ncnc(NC(=S)NCCN3CCOCC3)c21Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.61 |
| AlogP: | -1.2 | Num_rotatable_bonds: | 6 |
| MolWt: | 456.5 | Num_heavy_atoms: | 31 |
| TPSA: | 137.16 | NumAromaticRings: | 2 |
Unique Aglycone
AD40749
Formula: C13H16ON6FS
Smiles:
FC1=C[N]c2ncnc(NC(=S)NCCN3CCOCC3)c21| HBA: | 7 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.46 |
| AlogP: | 0.61 | Num_rotatable_bonds: | 4 |
| MolWt: | 323.38 | Num_heavy_atoms: | 22 |
| TPSA: | 76.41 | NumAromaticRings: | 1 |
