Glycoside
GD015927
Name:
NoneFormula:
C11H16O4N4Smiles:
Cn1cnc(-c2nc([C@H](O)[C@H](O)[C@H](O)CO)c[nH]2)c1Aglycone:
Cn1cnc(-c2ncc[nH]2)c1Sugarmoiety:
OCC(O)C(O)C(O)OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.45 |
| AlogP: | -1.44 | Num_rotatable_bonds: | 5 |
| MolWt: | 268.27 | Num_heavy_atoms: | 19 |
| TPSA: | 127.42 | NumAromaticRings: | 2 |
Unique Aglycone
AD11521
Formula: C7H8N4
Smiles:
Cn1cnc(-c2ncc[nH]2)c1| HBA: | 4 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.14 |
| AlogP: | 0.81 | Num_rotatable_bonds: | 1 |
| MolWt: | 148.17 | Num_heavy_atoms: | 11 |
| TPSA: | 46.5 | NumAromaticRings: | 2 |
