Glycoside
GD035546
Name:
NoneFormula:
C18H18O4N7F3Smiles:
Nc1nc(NN=Cc2ccc(C(F)(F)F)cc2)nc2c1ncn2[C@@H]1O[C@H](CO)[C@H](O)[C@H]1OAglycone:
Nc1nc(NN=Cc2ccc(C(F)(F)F)cc2)nc2c1N=C[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 6 | FractionCSP3: | 0.33 |
| AlogP: | 0.48 | Num_rotatable_bonds: | 5 |
| MolWt: | 453.38 | Num_heavy_atoms: | 32 |
| TPSA: | 163.93 | NumAromaticRings: | 3 |
Unique Aglycone
AD22486
Formula: C13H9N7F3
Smiles:
Nc1nc(NN=Cc2ccc(C(F)(F)F)cc2)nc2c1N=C[N]2| HBA: | 7 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.08 |
| AlogP: | 2.43 | Num_rotatable_bonds: | 3 |
| MolWt: | 320.26 | Num_heavy_atoms: | 23 |
| TPSA: | 102.65 | NumAromaticRings: | 2 |
