Glycoside
GD087864
Name:
NoneFormula:
C11H13O6N3Br2Smiles:
Cc1nc(NC(=O)C(=O)[C@H](O)[C@@H](O)[C@@H](O)CO)c(Br)nc1BrAglycone:
Cc1nc(N)c(Br)nc1BrSugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 9 | RingCount: | 1 |
| HBD: | 5 | FractionCSP3: | 0.45 |
| AlogP: | -1.11 | Num_rotatable_bonds: | 6 |
| MolWt: | 443.05 | Num_heavy_atoms: | 22 |
| TPSA: | 152.87 | NumAromaticRings: | 1 |
Unique Aglycone
AD38532
Formula: C5H5N3Br2
Smiles:
Cc1nc(N)c(Br)nc1Br| HBA: | 3 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.2 |
| AlogP: | 1.89 | Num_rotatable_bonds: | 0 |
| MolWt: | 266.92 | Num_heavy_atoms: | 10 |
| TPSA: | 51.8 | NumAromaticRings: | 1 |
