Glycoside
GD001916
Name:
NoneFormula:
C11H14O4N4Smiles:
OC[C@H](O)[C@H](O)[C@H](O)c1c[nH]c(-c2ncccn2)n1Aglycone:
c1cnc(-c2ncc[nH]2)nc1Sugarmoiety:
OCC(O)C(O)C(O)OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.36 |
| AlogP: | -1.39 | Num_rotatable_bonds: | 5 |
| MolWt: | 266.26 | Num_heavy_atoms: | 19 |
| TPSA: | 135.38 | NumAromaticRings: | 2 |
Unique Aglycone
AD01864
Formula: C7H6N4
Smiles:
c1cnc(-c2ncc[nH]2)nc1| HBA: | 4 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.0 |
| AlogP: | 0.87 | Num_rotatable_bonds: | 1 |
| MolWt: | 146.15 | Num_heavy_atoms: | 11 |
| TPSA: | 54.46 | NumAromaticRings: | 2 |
