Glycoside
GD091435
Name:
NoneFormula:
C16H18O6N3BrSmiles:
O=C(N[C@H]1[C@@H](O)O[C@H](CO)[C@@H](O)[C@@H]1O)c1cn(-c2ccccc2Br)cn1Aglycone:
NC(=O)c1cn(-c2ccccc2Br)cn1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.38 |
| AlogP: | -0.84 | Num_rotatable_bonds: | 4 |
| MolWt: | 428.24 | Num_heavy_atoms: | 26 |
| TPSA: | 137.07 | NumAromaticRings: | 2 |
Unique Aglycone
AD39894
Formula: C10H8ON3Br
Smiles:
NC(=O)c1cn(-c2ccccc2Br)cn1| HBA: | 4 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 1.73 | Num_rotatable_bonds: | 2 |
| MolWt: | 266.1 | Num_heavy_atoms: | 15 |
| TPSA: | 60.91 | NumAromaticRings: | 2 |
