Glycoside
GD074829
Name:
NoneFormula:
C18H20O6N4Smiles:
O=C(N[C@H]1[C@H](O)O[C@H](CO)[C@@H](O)[C@@H]1O)c1ccn(-c2ccc3ccccn23)n1Aglycone:
NC(=O)c1ccn(-c2ccc3ccccn23)n1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.33 |
| AlogP: | -1.35 | Num_rotatable_bonds: | 4 |
| MolWt: | 388.38 | Num_heavy_atoms: | 28 |
| TPSA: | 141.48 | NumAromaticRings: | 3 |
Unique Aglycone
AD34603
Formula: C12H10ON4
Smiles:
NC(=O)c1ccn(-c2ccc3ccccn23)n1| HBA: | 5 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 1.22 | Num_rotatable_bonds: | 2 |
| MolWt: | 226.24 | Num_heavy_atoms: | 17 |
| TPSA: | 65.32 | NumAromaticRings: | 3 |
