Glycoside
GD065508
Name:
NoneFormula:
C16H22O5N4Smiles:
CN(C)c1ncc2cc(N[C@H]3[C@H](O)O[C@H](CO)[C@@H](O)[C@@H]3O)ccc2n1Aglycone:
CN(C)c1ncc2cc(N)ccc2n1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.5 |
| AlogP: | -1.09 | Num_rotatable_bonds: | 4 |
| MolWt: | 350.38 | Num_heavy_atoms: | 25 |
| TPSA: | 131.2 | NumAromaticRings: | 2 |
Unique Aglycone
AD31502
Formula: C10H12N4
Smiles:
CN(C)c1ncc2cc(N)ccc2n1| HBA: | 4 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.2 |
| AlogP: | 1.28 | Num_rotatable_bonds: | 1 |
| MolWt: | 188.23 | Num_heavy_atoms: | 14 |
| TPSA: | 55.04 | NumAromaticRings: | 2 |
