Glycoside
GD035226
Name:
NoneFormula:
C19H22O4N4SSmiles:
CC(C)(Sc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@H](O)[C@H]1O)c1ccccc1Aglycone:
CC(C)(Sc1ncnc2c1N=C[N]2)c1ccccc1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 4 |
| HBD: | 3 | FractionCSP3: | 0.42 |
| AlogP: | 1.47 | Num_rotatable_bonds: | 5 |
| MolWt: | 402.48 | Num_heavy_atoms: | 28 |
| TPSA: | 113.52 | NumAromaticRings: | 3 |
Unique Aglycone
AD22305
Formula: C14H13N4S
Smiles:
CC(C)(Sc1ncnc2c1N=C[N]2)c1ccccc1| HBA: | 4 | RingCount: | 3 |
| HBD: | 0 | FractionCSP3: | 0.21 |
| AlogP: | 3.41 | Num_rotatable_bonds: | 3 |
| MolWt: | 269.35 | Num_heavy_atoms: | 19 |
| TPSA: | 52.24 | NumAromaticRings: | 2 |
