Glycoside
GD083904
Name:
NoneFormula:
C19H25O5N5Smiles:
NC(=O)c1ncn([C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c1Nc1cccc(N2CCCC2)c1Aglycone:
NC(=O)C1=C(Nc2cccc(N3CCCC3)c2)[N]C=N1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 6 | FractionCSP3: | 0.47 |
| AlogP: | -0.06 | Num_rotatable_bonds: | 6 |
| MolWt: | 403.44 | Num_heavy_atoms: | 29 |
| TPSA: | 146.1 | NumAromaticRings: | 2 |
Unique Aglycone
AD37414
Formula: C14H16ON5
Smiles:
NC(=O)C1=C(Nc2cccc(N3CCCC3)c2)[N]C=N1| HBA: | 6 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.29 |
| AlogP: | 1.0 | Num_rotatable_bonds: | 4 |
| MolWt: | 270.32 | Num_heavy_atoms: | 20 |
| TPSA: | 84.82 | NumAromaticRings: | 1 |
