Glycoside
GD011997
Name:
NoneFormula:
C17H18O7N4Smiles:
O=C1c2ccccc2C(=O)N1Cc1cn([C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)nn1Aglycone:
O=C1c2ccccc2C(=O)N1CC1=C[N]N=N1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.41 |
| AlogP: | -1.95 | Num_rotatable_bonds: | 4 |
| MolWt: | 390.35 | Num_heavy_atoms: | 28 |
| TPSA: | 158.24 | NumAromaticRings: | 2 |
Unique Aglycone
AD09081
Formula: C11H7O2N4
Smiles:
O=C1c2ccccc2C(=O)N1CC1=C[N]N=N1| HBA: | 6 | RingCount: | 3 |
| HBD: | 0 | FractionCSP3: | 0.09 |
| AlogP: | 1.11 | Num_rotatable_bonds: | 2 |
| MolWt: | 227.2 | Num_heavy_atoms: | 17 |
| TPSA: | 76.2 | NumAromaticRings: | 1 |
