Glycoside
GD070635
Name:
NoneFormula:
C19H18O4N4Smiles:
C#Cc1cccc(Nc2ncnc3c2ccn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c1Aglycone:
C#Cc1cccc(Nc2ncnc3c2C=C[N]3)c1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.26 |
| AlogP: | 0.77 | Num_rotatable_bonds: | 4 |
| MolWt: | 366.38 | Num_heavy_atoms: | 27 |
| TPSA: | 112.66 | NumAromaticRings: | 3 |
Unique Aglycone
AD33461
Formula: C14H9N4
Smiles:
C#Cc1cccc(Nc2ncnc3c2C=C[N]3)c1| HBA: | 4 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.0 |
| AlogP: | 2.42 | Num_rotatable_bonds: | 2 |
| MolWt: | 233.25 | Num_heavy_atoms: | 18 |
| TPSA: | 51.91 | NumAromaticRings: | 2 |
