Glycoside
GD070228
Name:
NoneFormula:
C15H18O6N2SSmiles:
OC[C@H]1O[C@@H](Oc2ccc(Nc3nccs3)cc2)[C@H](O)[C@@H](O)[C@H]1OAglycone:
Oc1ccc(Nc2nccs2)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.4 |
| AlogP: | 0.07 | Num_rotatable_bonds: | 5 |
| MolWt: | 354.38 | Num_heavy_atoms: | 24 |
| TPSA: | 124.3 | NumAromaticRings: | 2 |
Unique Aglycone
AD33262
Formula: C9H8ON2S
Smiles:
Oc1ccc(Nc2nccs2)cc1| HBA: | 3 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 2.59 | Num_rotatable_bonds: | 2 |
| MolWt: | 192.24 | Num_heavy_atoms: | 13 |
| TPSA: | 45.15 | NumAromaticRings: | 2 |
