Glycoside
GD050760
Name:
NoneFormula:
C14H18O5N4Smiles:
N#Cc1cc(N[C@H]2[C@H](O)O[C@H](CO)[C@@H](O)[C@@H]2O)nc(C2CC2)n1Aglycone:
N#Cc1cc(N)nc(C2CC2)n1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.64 |
| AlogP: | -1.56 | Num_rotatable_bonds: | 4 |
| MolWt: | 322.32 | Num_heavy_atoms: | 23 |
| TPSA: | 151.75 | NumAromaticRings: | 1 |
Unique Aglycone
AD26724
Formula: C8H8N4
Smiles:
N#Cc1cc(N)nc(C2CC2)n1| HBA: | 4 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.38 |
| AlogP: | 0.81 | Num_rotatable_bonds: | 1 |
| MolWt: | 160.18 | Num_heavy_atoms: | 12 |
| TPSA: | 75.59 | NumAromaticRings: | 1 |
