Glycoside
GD078672
Name:
NoneFormula:
C16H19O5N2BrSmiles:
Cc1cc(N[C@H]2[C@@H](O)O[C@H](CO)[C@@H](O)[C@@H]2O)nc2ccc(Br)cc12Aglycone:
Cc1cc(N)nc2ccc(Br)cc12Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.44 |
| AlogP: | 0.52 | Num_rotatable_bonds: | 3 |
| MolWt: | 399.24 | Num_heavy_atoms: | 24 |
| TPSA: | 115.07 | NumAromaticRings: | 2 |
Unique Aglycone
AD36153
Formula: C10H9N2Br
Smiles:
Cc1cc(N)nc2ccc(Br)cc12| HBA: | 2 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.1 |
| AlogP: | 2.89 | Num_rotatable_bonds: | 0 |
| MolWt: | 237.1 | Num_heavy_atoms: | 13 |
| TPSA: | 38.91 | NumAromaticRings: | 2 |
