Glycoside
GD019343
Name:
NoneFormula:
C14H15O4N3S2Smiles:
CSc1ncnc2c1c1sccc1n2[C@@H]1O[C@H](CO)[C@H](O)[C@H]1OAglycone:
CSc1ncnc2c1-c1sccc1[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 4 |
| HBD: | 3 | FractionCSP3: | 0.43 |
| AlogP: | 0.98 | Num_rotatable_bonds: | 3 |
| MolWt: | 353.43 | Num_heavy_atoms: | 23 |
| TPSA: | 100.63 | NumAromaticRings: | 3 |
Unique Aglycone
AD06458
Formula: C9H6N3S2
Smiles:
CSc1ncnc2c1-c1sccc1[N]2| HBA: | 3 | RingCount: | 3 |
| HBD: | 0 | FractionCSP3: | 0.11 |
| AlogP: | 2.81 | Num_rotatable_bonds: | 1 |
| MolWt: | 220.3 | Num_heavy_atoms: | 14 |
| TPSA: | 39.88 | NumAromaticRings: | 2 |
