Glycoside
GD085908
Name:
NoneFormula:
C20H20O4N6Smiles:
N#CC1(c2ccc(Nc3ncnc4c3ncn4[C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)cc2)CC1Aglycone:
N#CC1(c2ccc(Nc3ncnc4c3N=C[N]4)cc2)CC1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 5 |
| HBD: | 4 | FractionCSP3: | 0.4 |
| AlogP: | 0.74 | Num_rotatable_bonds: | 5 |
| MolWt: | 408.42 | Num_heavy_atoms: | 30 |
| TPSA: | 149.34 | NumAromaticRings: | 3 |
Unique Aglycone
AD38242
Formula: C15H11N6
Smiles:
N#CC1(c2ccc(Nc3ncnc4c3N=C[N]4)cc2)CC1| HBA: | 6 | RingCount: | 4 |
| HBD: | 1 | FractionCSP3: | 0.2 |
| AlogP: | 2.68 | Num_rotatable_bonds: | 3 |
| MolWt: | 275.3 | Num_heavy_atoms: | 21 |
| TPSA: | 88.06 | NumAromaticRings: | 2 |
