Glycoside
GD068554
Name:
NoneFormula:
C12H14O4N5BrSmiles:
C=CNc1ncnc2c1nc(Br)n2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1OAglycone:
C=CNc1ncnc2c1N=C(Br)[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.42 |
| AlogP: | -0.24 | Num_rotatable_bonds: | 4 |
| MolWt: | 372.18 | Num_heavy_atoms: | 22 |
| TPSA: | 125.55 | NumAromaticRings: | 2 |
Unique Aglycone
AD32478
Formula: C7H5N5Br
Smiles:
C=CNc1ncnc2c1N=C(Br)[N]2| HBA: | 5 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.0 |
| AlogP: | 1.66 | Num_rotatable_bonds: | 2 |
| MolWt: | 239.06 | Num_heavy_atoms: | 13 |
| TPSA: | 64.27 | NumAromaticRings: | 1 |
