Glycoside
GD065749
Name:
NoneFormula:
C9H11O6N2SBrSmiles:
O=C(Nc1csc(Br)n1)C(=O)[C@H](O)[C@H](O)[C@H](O)COAglycone:
Nc1csc(Br)n1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 8 | RingCount: | 1 |
| HBD: | 5 | FractionCSP3: | 0.44 |
| AlogP: | -1.51 | Num_rotatable_bonds: | 6 |
| MolWt: | 355.17 | Num_heavy_atoms: | 19 |
| TPSA: | 139.98 | NumAromaticRings: | 1 |
Unique Aglycone
AD31630
Formula: C3H3N2SBr
Smiles:
Nc1csc(Br)n1| HBA: | 2 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 1.49 | Num_rotatable_bonds: | 0 |
| MolWt: | 179.04 | Num_heavy_atoms: | 7 |
| TPSA: | 38.91 | NumAromaticRings: | 1 |
