Glycoside
GD023584
Name:
NoneFormula:
C13H14O4N4SSmiles:
Nc1ncnc2c1c1sccc1n2[C@@H]1O[C@H](CO)[C@H](O)[C@H]1OAglycone:
Nc1ncnc2c1-c1sccc1[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.38 |
| AlogP: | -0.16 | Num_rotatable_bonds: | 2 |
| MolWt: | 322.35 | Num_heavy_atoms: | 22 |
| TPSA: | 126.65 | NumAromaticRings: | 3 |
Unique Aglycone
AD15846
Formula: C8H5N4S
Smiles:
Nc1ncnc2c1-c1sccc1[N]2| HBA: | 4 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 1.67 | Num_rotatable_bonds: | 0 |
| MolWt: | 189.22 | Num_heavy_atoms: | 13 |
| TPSA: | 65.9 | NumAromaticRings: | 2 |
