Glycoside
GD014651
Name:
NoneFormula:
C20H22O6N4Smiles:
O=C(NCc1cccnc1)c1ccc2[nH]c([C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)nc2c1Aglycone:
O=C(NCc1cccnc1)c1ccc2[nH]cnc2c1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 6 | FractionCSP3: | 0.35 |
| AlogP: | -0.6 | Num_rotatable_bonds: | 5 |
| MolWt: | 414.42 | Num_heavy_atoms: | 30 |
| TPSA: | 160.82 | NumAromaticRings: | 3 |
Unique Aglycone
AD10750
Formula: C14H12ON4
Smiles:
O=C(NCc1cccnc1)c1ccc2[nH]cnc2c1| HBA: | 5 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.07 |
| AlogP: | 1.89 | Num_rotatable_bonds: | 3 |
| MolWt: | 252.28 | Num_heavy_atoms: | 19 |
| TPSA: | 70.67 | NumAromaticRings: | 3 |
