Glycoside
GD077304
Name:
NoneFormula:
C18H17O5N5Smiles:
C#Cc1ccc(Nc2[nH]c(=O)nc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)cc1Aglycone:
C#Cc1ccc(Nc2[nH]c(=O)nc3c2N=C[N]3)cc1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.28 |
| AlogP: | -0.54 | Num_rotatable_bonds: | 4 |
| MolWt: | 383.36 | Num_heavy_atoms: | 28 |
| TPSA: | 145.52 | NumAromaticRings: | 3 |
Unique Aglycone
AD35474
Formula: C13H8ON5
Smiles:
C#Cc1ccc(Nc2[nH]c(=O)nc3c2N=C[N]3)cc1| HBA: | 6 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 1.4 | Num_rotatable_bonds: | 2 |
| MolWt: | 250.24 | Num_heavy_atoms: | 19 |
| TPSA: | 84.24 | NumAromaticRings: | 2 |
