Glycoside
GD083069
Name:
NoneFormula:
C19H20O6N4Smiles:
Cn1c(N[C@@H]2O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]2O)nc2ncc(-c3ccccc3)cc21Aglycone:
Cn1c(N)nc2ncc(-c3ccccc3)cc21Sugarmoiety:
O=C(O)C1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.32 |
| AlogP: | -0.06 | Num_rotatable_bonds: | 4 |
| MolWt: | 400.39 | Num_heavy_atoms: | 29 |
| TPSA: | 149.96 | NumAromaticRings: | 3 |
Unique Aglycone
AD37146
Formula: C13H12N4
Smiles:
Cn1c(N)nc2ncc(-c3ccccc3)cc21| HBA: | 4 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.08 |
| AlogP: | 2.22 | Num_rotatable_bonds: | 1 |
| MolWt: | 224.27 | Num_heavy_atoms: | 17 |
| TPSA: | 56.73 | NumAromaticRings: | 3 |
