Glycoside
GD060096
Name:
NoneFormula:
C12H14O4N5F3Smiles:
OC[C@H]1O[C@@H](n2cnc3c(NCC(F)(F)F)ncnc32)[C@H](O)[C@@H]1OAglycone:
FC(F)(F)CNc1ncnc2c1N=C[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.58 |
| AlogP: | -0.59 | Num_rotatable_bonds: | 4 |
| MolWt: | 349.27 | Num_heavy_atoms: | 24 |
| TPSA: | 125.55 | NumAromaticRings: | 2 |
Unique Aglycone
AD29698
Formula: C7H5N5F3
Smiles:
FC(F)(F)CNc1ncnc2c1N=C[N]2| HBA: | 5 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.29 |
| AlogP: | 1.36 | Num_rotatable_bonds: | 2 |
| MolWt: | 216.15 | Num_heavy_atoms: | 15 |
| TPSA: | 64.27 | NumAromaticRings: | 1 |
