Glycoside
GD102029
Name:
NoneFormula:
C12H11O6N2F3Br2Smiles:
O=C(Nc1ncc(Br)c(C(F)(F)F)c1Br)C(=O)[C@H](O)[C@H](O)[C@H](O)COAglycone:
Nc1ncc(Br)c(C(F)(F)F)c1BrSugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 8 | RingCount: | 1 |
| HBD: | 5 | FractionCSP3: | 0.42 |
| AlogP: | 0.21 | Num_rotatable_bonds: | 6 |
| MolWt: | 496.03 | Num_heavy_atoms: | 25 |
| TPSA: | 139.98 | NumAromaticRings: | 1 |
Unique Aglycone
AD43198
Formula: C6H3N2F3Br2
Smiles:
Nc1ncc(Br)c(C(F)(F)F)c1Br| HBA: | 2 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.17 |
| AlogP: | 3.21 | Num_rotatable_bonds: | 0 |
| MolWt: | 319.91 | Num_heavy_atoms: | 13 |
| TPSA: | 38.91 | NumAromaticRings: | 1 |
