Glycoside
GD081065
Name:
NoneFormula:
C19H24O7N4Smiles:
O=C(c1ccc(-c2cn([C@H]3[C@H](O)O[C@H](CO)[C@@H](O)[C@@H]3O)nn2)cc1)N1CCOCC1Aglycone:
O=C(c1ccc(C2=C[N]N=N2)cc1)N1CCOCC1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.53 |
| AlogP: | -1.61 | Num_rotatable_bonds: | 4 |
| MolWt: | 420.42 | Num_heavy_atoms: | 30 |
| TPSA: | 150.4 | NumAromaticRings: | 2 |
Unique Aglycone
AD36553
Formula: C13H13O2N4
Smiles:
O=C(c1ccc(C2=C[N]N=N2)cc1)N1CCOCC1| HBA: | 6 | RingCount: | 3 |
| HBD: | 0 | FractionCSP3: | 0.31 |
| AlogP: | 1.44 | Num_rotatable_bonds: | 2 |
| MolWt: | 257.27 | Num_heavy_atoms: | 19 |
| TPSA: | 68.36 | NumAromaticRings: | 1 |
