Glycoside
GD078829
Name:
NoneFormula:
C19H20O4N6Smiles:
N#CCc1ccc(CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)cc1Aglycone:
N#CCc1ccc(CNc2ncnc3c2N=C[N]3)cc1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.37 |
| AlogP: | 0.12 | Num_rotatable_bonds: | 6 |
| MolWt: | 396.41 | Num_heavy_atoms: | 29 |
| TPSA: | 149.34 | NumAromaticRings: | 3 |
Unique Aglycone
AD36216
Formula: C14H11N6
Smiles:
N#CCc1ccc(CNc2ncnc3c2N=C[N]3)cc1| HBA: | 6 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.14 |
| AlogP: | 2.06 | Num_rotatable_bonds: | 4 |
| MolWt: | 263.28 | Num_heavy_atoms: | 20 |
| TPSA: | 88.06 | NumAromaticRings: | 2 |
