Glycoside
GD029613
Name:
NoneFormula:
C16H16O4N6Smiles:
N#Cc1c(-c2ccc[nH]2)n([C@@H]2O[C@H](CO)[C@H](O)[C@H]2O)c2ncnc(N)c12Aglycone:
N#CC1=C(c2ccc[nH]2)[N]c2ncnc(N)c21Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 6 | FractionCSP3: | 0.31 |
| AlogP: | -0.51 | Num_rotatable_bonds: | 3 |
| MolWt: | 356.34 | Num_heavy_atoms: | 26 |
| TPSA: | 166.23 | NumAromaticRings: | 3 |
Unique Aglycone
AD19248
Formula: C11H7N6
Smiles:
N#CC1=C(c2ccc[nH]2)[N]c2ncnc(N)c21| HBA: | 6 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.0 |
| AlogP: | 1.03 | Num_rotatable_bonds: | 1 |
| MolWt: | 223.22 | Num_heavy_atoms: | 17 |
| TPSA: | 105.48 | NumAromaticRings: | 2 |
