Glycoside
GD001278
Name:
NoneFormula:
C15H17O4N5SSmiles:
OC[C@@H]1OC(n2cnc3c(NCc4ccsc4)ncnc32)[C@H](O)[C@H]1OAglycone:
C1=Nc2c(ncnc2NCc2ccsc2)[N]1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.4 |
| AlogP: | 0.11 | Num_rotatable_bonds: | 5 |
| MolWt: | 363.4 | Num_heavy_atoms: | 25 |
| TPSA: | 125.55 | NumAromaticRings: | 3 |
Unique Aglycone
AD01313
Formula: C10H8N5S
Smiles:
C1=Nc2c(ncnc2NCc2ccsc2)[N]1| HBA: | 5 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.1 |
| AlogP: | 2.06 | Num_rotatable_bonds: | 3 |
| MolWt: | 230.28 | Num_heavy_atoms: | 16 |
| TPSA: | 64.27 | NumAromaticRings: | 2 |
