Glycoside
GD103797
Name:
NoneFormula:
C19H20O5N6S2Smiles:
CSC[C@H]1O[C@@H](n2cnc3c(NS(=O)(=O)c4ccc(C)c(C#N)c4)ncnc32)[C@H](O)[C@@H]1OAglycone:
Cc1ccc(S(=O)(=O)Nc2ncnc3c2N=C[N]3)cc1C#NSugarmoiety:
CSCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 3 | FractionCSP3: | 0.37 |
| AlogP: | 0.79 | Num_rotatable_bonds: | 6 |
| MolWt: | 476.54 | Num_heavy_atoms: | 32 |
| TPSA: | 163.25 | NumAromaticRings: | 3 |
Unique Aglycone
AD43886
Formula: C13H9O2N6S
Smiles:
Cc1ccc(S(=O)(=O)Nc2ncnc3c2N=C[N]3)cc1C#N| HBA: | 8 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.08 |
| AlogP: | 1.37 | Num_rotatable_bonds: | 3 |
| MolWt: | 313.32 | Num_heavy_atoms: | 22 |
| TPSA: | 122.2 | NumAromaticRings: | 2 |
