Glycoside
GD024597
Name:
NoneFormula:
C17H18O4N4SSmiles:
Nc1ncnc2c1c(Sc1ccccc1)cn2[C@@H]1O[C@H](CO)[C@H](O)[C@H]1OAglycone:
Nc1ncnc2c1C(Sc1ccccc1)=C[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.29 |
| AlogP: | 0.78 | Num_rotatable_bonds: | 4 |
| MolWt: | 374.42 | Num_heavy_atoms: | 26 |
| TPSA: | 126.65 | NumAromaticRings: | 3 |
Unique Aglycone
AD16392
Formula: C12H9N4S
Smiles:
Nc1ncnc2c1C(Sc1ccccc1)=C[N]2| HBA: | 4 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 2.4 | Num_rotatable_bonds: | 2 |
| MolWt: | 241.3 | Num_heavy_atoms: | 17 |
| TPSA: | 65.9 | NumAromaticRings: | 2 |
