Glycoside
GD025017
Name:
NoneFormula:
C13H18O4N4SSmiles:
CSCCc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@H](O)[C@H]1OAglycone:
CSCCc1ncnc2c1N=C[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.62 |
| AlogP: | -0.66 | Num_rotatable_bonds: | 5 |
| MolWt: | 326.38 | Num_heavy_atoms: | 22 |
| TPSA: | 113.52 | NumAromaticRings: | 2 |
Unique Aglycone
AD16635
Formula: C8H9N4S
Smiles:
CSCCc1ncnc2c1N=C[N]2| HBA: | 4 | RingCount: | 2 |
| HBD: | 0 | FractionCSP3: | 0.38 |
| AlogP: | 1.29 | Num_rotatable_bonds: | 3 |
| MolWt: | 193.25 | Num_heavy_atoms: | 13 |
| TPSA: | 52.24 | NumAromaticRings: | 1 |
