Glycoside
GD083926
Name:
NoneFormula:
C14H15O5N3FBrSmiles:
OC[C@H]1O[C@H](O)[C@H](Nc2ncc3cc(F)cc(Br)c3n2)[C@@H](O)[C@@H]1OAglycone:
Nc1ncc2cc(F)cc(Br)c2n1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.43 |
| AlogP: | -0.26 | Num_rotatable_bonds: | 3 |
| MolWt: | 404.19 | Num_heavy_atoms: | 24 |
| TPSA: | 127.96 | NumAromaticRings: | 2 |
Unique Aglycone
AD37430
Formula: C8H5N3FBr
Smiles:
Nc1ncc2cc(F)cc(Br)c2n1| HBA: | 3 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 2.11 | Num_rotatable_bonds: | 0 |
| MolWt: | 242.05 | Num_heavy_atoms: | 13 |
| TPSA: | 51.8 | NumAromaticRings: | 2 |
