Glycoside
GD052159
Name:
NoneFormula:
C12H12O4N4SSmiles:
N#Cc1cn([C@@H]2O[C@@H](CO)[C@@H](O)[C@H]2O)c2nc[nH]c(=S)c12Aglycone:
N#CC1=C[N]c2nc[nH]c(=S)c21Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.42 |
| AlogP: | -0.42 | Num_rotatable_bonds: | 2 |
| MolWt: | 308.32 | Num_heavy_atoms: | 21 |
| TPSA: | 127.32 | NumAromaticRings: | 2 |
Unique Aglycone
AD27093
Formula: C7H3N4S
Smiles:
N#CC1=C[N]c2nc[nH]c(=S)c21| HBA: | 4 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.0 |
| AlogP: | 1.25 | Num_rotatable_bonds: | 0 |
| MolWt: | 175.2 | Num_heavy_atoms: | 12 |
| TPSA: | 66.57 | NumAromaticRings: | 1 |
