Glycoside
GD060245
Name:
NoneFormula:
C17H21O5N3Smiles:
OC[C@H]1O[C@@H](O)[C@H](Nc2cccc(Cc3ccncc3)n2)[C@@H](O)[C@@H]1OAglycone:
Nc1cccc(Cc2ccncc2)n1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.41 |
| AlogP: | -0.72 | Num_rotatable_bonds: | 5 |
| MolWt: | 347.37 | Num_heavy_atoms: | 25 |
| TPSA: | 127.96 | NumAromaticRings: | 2 |
Unique Aglycone
AD29773
Formula: C11H11N3
Smiles:
Nc1cccc(Cc2ccncc2)n1| HBA: | 3 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.09 |
| AlogP: | 1.65 | Num_rotatable_bonds: | 2 |
| MolWt: | 185.23 | Num_heavy_atoms: | 14 |
| TPSA: | 51.8 | NumAromaticRings: | 2 |
