Glycoside
GD060283
Name:
NoneFormula:
C17H20O5N2Smiles:
OC[C@H]1O[C@@H](O)[C@H](Nc2cncc(-c3ccccc3)c2)[C@@H](O)[C@@H]1OAglycone:
Nc1cncc(-c2ccccc2)c1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.35 |
| AlogP: | -0.04 | Num_rotatable_bonds: | 4 |
| MolWt: | 332.36 | Num_heavy_atoms: | 24 |
| TPSA: | 115.07 | NumAromaticRings: | 2 |
Unique Aglycone
AD29550
Formula: C11H10N2
Smiles:
Nc1cncc(-c2ccccc2)c1| HBA: | 2 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 2.33 | Num_rotatable_bonds: | 1 |
| MolWt: | 170.22 | Num_heavy_atoms: | 13 |
| TPSA: | 38.91 | NumAromaticRings: | 2 |
