Glycoside
GD019679
Name:
NoneFormula:
C21H20O4N4Smiles:
Nc1ncnc2c1c(-c1cccc3ccccc13)cn2[C@@H]1O[C@H](CO)[C@H](O)[C@H]1OAglycone:
Nc1ncnc2c1C(c1cccc3ccccc13)=C[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 5 |
| HBD: | 5 | FractionCSP3: | 0.24 |
| AlogP: | 1.45 | Num_rotatable_bonds: | 3 |
| MolWt: | 392.42 | Num_heavy_atoms: | 29 |
| TPSA: | 126.65 | NumAromaticRings: | 4 |
Unique Aglycone
AD13708
Formula: C16H11N4
Smiles:
Nc1ncnc2c1C(c1cccc3ccccc13)=C[N]2| HBA: | 4 | RingCount: | 4 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 2.85 | Num_rotatable_bonds: | 1 |
| MolWt: | 259.29 | Num_heavy_atoms: | 20 |
| TPSA: | 65.9 | NumAromaticRings: | 3 |
