Glycoside
GD078849
Name:
NoneFormula:
C19H19O4N5Smiles:
C#Cc1cccc(Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2OC)c1Aglycone:
C#Cc1cccc(Nc2ncnc3c2N=C[N]3)c1Sugarmoiety:
COC1C(O)OC(CO)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 4 |
| HBD: | 3 | FractionCSP3: | 0.32 |
| AlogP: | 0.82 | Num_rotatable_bonds: | 5 |
| MolWt: | 381.39 | Num_heavy_atoms: | 28 |
| TPSA: | 114.55 | NumAromaticRings: | 3 |
Unique Aglycone
AD23888
Formula: C13H8N5
Smiles:
C#Cc1cccc(Nc2ncnc3c2N=C[N]3)c1| HBA: | 5 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.0 |
| AlogP: | 2.11 | Num_rotatable_bonds: | 2 |
| MolWt: | 234.24 | Num_heavy_atoms: | 18 |
| TPSA: | 64.27 | NumAromaticRings: | 2 |
