Glycoside
GD083651
Name:
NoneFormula:
C18H21O6N3SSmiles:
Cc1cc(C)nc(Sc2ccc(NC(=O)C(=O)[C@H](O)[C@H](O)[C@H](O)CO)cc2)n1Aglycone:
Cc1cc(C)nc(Sc2ccc(N)cc2)n1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.33 |
| AlogP: | -0.17 | Num_rotatable_bonds: | 8 |
| MolWt: | 407.45 | Num_heavy_atoms: | 28 |
| TPSA: | 152.87 | NumAromaticRings: | 2 |
Unique Aglycone
AD37300
Formula: C12H13N3S
Smiles:
Cc1cc(C)nc(Sc2ccc(N)cc2)n1| HBA: | 3 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.17 |
| AlogP: | 2.83 | Num_rotatable_bonds: | 2 |
| MolWt: | 231.32 | Num_heavy_atoms: | 16 |
| TPSA: | 51.8 | NumAromaticRings: | 2 |
