Glycoside
GD022408
Name:
NoneFormula:
C16H18O4N6SSmiles:
Nc1nc(SCc2ccccc2)nc2c1nnn2[C@@H]1O[C@H](CO)[C@H](O)[C@H]1OAglycone:
Nc1nc(SCc2ccccc2)nc2c1N=N[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.38 |
| AlogP: | -0.29 | Num_rotatable_bonds: | 5 |
| MolWt: | 390.43 | Num_heavy_atoms: | 27 |
| TPSA: | 152.43 | NumAromaticRings: | 3 |
Unique Aglycone
AD15195
Formula: C11H9N6S
Smiles:
Nc1nc(SCc2ccccc2)nc2c1N=N[N]2| HBA: | 6 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.09 |
| AlogP: | 2.6 | Num_rotatable_bonds: | 3 |
| MolWt: | 257.3 | Num_heavy_atoms: | 18 |
| TPSA: | 90.62 | NumAromaticRings: | 2 |
