Glycoside
GD026296
Name:
NoneFormula:
C16H18O4N6Smiles:
C[C@]1(O)[C@H](O)[C@H](CO)O[C@H]1n1cc(-c2ncccn2)c2c(N)ncnc21Aglycone:
Nc1ncnc2c1C(c1ncccn1)=C[N]2Sugarmoiety:
CC1(O)C(O)OC(CO)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.38 |
| AlogP: | -0.53 | Num_rotatable_bonds: | 3 |
| MolWt: | 358.36 | Num_heavy_atoms: | 26 |
| TPSA: | 152.43 | NumAromaticRings: | 3 |
Unique Aglycone
AD17342
Formula: C10H7N6
Smiles:
Nc1ncnc2c1C(c1ncccn1)=C[N]2| HBA: | 6 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 0.49 | Num_rotatable_bonds: | 1 |
| MolWt: | 211.21 | Num_heavy_atoms: | 16 |
| TPSA: | 91.68 | NumAromaticRings: | 2 |
