Glycoside
GD016993
Name:
NoneFormula:
C12H13O6N4BrSmiles:
NC(=O)c1c(Br)n(O[C@@H]2O[C@H](CO)[C@H](O)[C@H]2O)c2ncncc12Aglycone:
NC(=O)c1c(Br)n(O)c2ncncc12Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.42 |
| AlogP: | -1.84 | Num_rotatable_bonds: | 4 |
| MolWt: | 389.16 | Num_heavy_atoms: | 23 |
| TPSA: | 152.95 | NumAromaticRings: | 2 |
Unique Aglycone
AD12175
Formula: C7H5O2N4Br
Smiles:
NC(=O)c1c(Br)n(O)c2ncncc12| HBA: | 6 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.0 |
| AlogP: | 0.53 | Num_rotatable_bonds: | 1 |
| MolWt: | 257.05 | Num_heavy_atoms: | 14 |
| TPSA: | 94.03 | NumAromaticRings: | 2 |
