Glycoside
GD024860
Name:
NoneFormula:
C16H17O5N5SSmiles:
NC(=O)c1c(-c2cccs2)n([C@@H]2O[C@H](CO)[C@H](O)[C@H]2O)c2ncnc(N)c12Aglycone:
NC(=O)C1=C(c2cccs2)[N]c2ncnc(N)c21Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 7 | FractionCSP3: | 0.31 |
| AlogP: | -0.55 | Num_rotatable_bonds: | 4 |
| MolWt: | 391.41 | Num_heavy_atoms: | 27 |
| TPSA: | 169.74 | NumAromaticRings: | 3 |
Unique Aglycone
AD16550
Formula: C11H8ON5S
Smiles:
NC(=O)C1=C(c2cccs2)[N]c2ncnc(N)c21| HBA: | 6 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.0 |
| AlogP: | 0.72 | Num_rotatable_bonds: | 2 |
| MolWt: | 258.29 | Num_heavy_atoms: | 18 |
| TPSA: | 108.99 | NumAromaticRings: | 2 |
