Glycoside
GD092425
Name:
NoneFormula:
C21H22O5N6Smiles:
C#Cc1cccc(NC(=O)CN(C)c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c1Aglycone:
C#Cc1cccc(NC(=O)CN(C)c2ncnc3c2N=C[N]3)c1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.33 |
| AlogP: | -0.51 | Num_rotatable_bonds: | 6 |
| MolWt: | 438.44 | Num_heavy_atoms: | 32 |
| TPSA: | 145.86 | NumAromaticRings: | 3 |
Unique Aglycone
AD40326
Formula: C16H13ON6
Smiles:
C#Cc1cccc(NC(=O)CN(C)c2ncnc3c2N=C[N]3)c1| HBA: | 7 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.12 |
| AlogP: | 1.44 | Num_rotatable_bonds: | 4 |
| MolWt: | 305.32 | Num_heavy_atoms: | 23 |
| TPSA: | 84.58 | NumAromaticRings: | 2 |
