Glycoside
GD090804
Name:
NoneFormula:
C19H28O6N4SSmiles:
Cc1sc2nc(CN3CCOCC3)nc(N[C@H]3[C@H](O)O[C@H](CO)[C@@H](O)[C@@H]3O)c2c1CAglycone:
Cc1sc2nc(CN3CCOCC3)nc(N)c2c1CSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.68 |
| AlogP: | -0.65 | Num_rotatable_bonds: | 5 |
| MolWt: | 440.52 | Num_heavy_atoms: | 30 |
| TPSA: | 140.43 | NumAromaticRings: | 2 |
Unique Aglycone
AD39529
Formula: C13H18ON4S
Smiles:
Cc1sc2nc(CN3CCOCC3)nc(N)c2c1C| HBA: | 5 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.54 |
| AlogP: | 1.72 | Num_rotatable_bonds: | 2 |
| MolWt: | 278.38 | Num_heavy_atoms: | 19 |
| TPSA: | 64.27 | NumAromaticRings: | 2 |
