Glycoside
GD023154
Name:
NoneFormula:
C13H14O4N6S2Smiles:
Nc1ncnc2c1c1c(S)nc(S)nc1n2C1O[C@H](CO)[C@H](O)[C@H]1OAglycone:
Nc1ncnc2c1-c1c(S)nc(S)nc1[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.38 |
| AlogP: | -0.85 | Num_rotatable_bonds: | 2 |
| MolWt: | 382.43 | Num_heavy_atoms: | 25 |
| TPSA: | 152.43 | NumAromaticRings: | 3 |
Unique Aglycone
AD15604
Formula: C8H5N6S2
Smiles:
Nc1ncnc2c1-c1c(S)nc(S)nc1[N]2| HBA: | 6 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 0.97 | Num_rotatable_bonds: | 0 |
| MolWt: | 249.3 | Num_heavy_atoms: | 16 |
| TPSA: | 91.68 | NumAromaticRings: | 2 |
