Glycoside
GD091217
Name:
NoneFormula:
C17H18O6N4S2Smiles:
CS(=O)(=O)c1ccc(Sc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)cc1Aglycone:
CS(=O)(=O)c1ccc(Sc2ncnc3c2N=C[N]3)cc1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 3 | FractionCSP3: | 0.35 |
| AlogP: | -0.01 | Num_rotatable_bonds: | 5 |
| MolWt: | 438.49 | Num_heavy_atoms: | 29 |
| TPSA: | 147.66 | NumAromaticRings: | 3 |
Unique Aglycone
AD39768
Formula: C12H9O2N4S2
Smiles:
CS(=O)(=O)c1ccc(Sc2ncnc3c2N=C[N]3)cc1| HBA: | 6 | RingCount: | 3 |
| HBD: | 0 | FractionCSP3: | 0.08 |
| AlogP: | 1.94 | Num_rotatable_bonds: | 3 |
| MolWt: | 305.36 | Num_heavy_atoms: | 20 |
| TPSA: | 86.38 | NumAromaticRings: | 2 |
