Glycoside
GD016279
Name:
NoneFormula:
C21H20O5N7F3Smiles:
OCc1cnn(-c2nc(Nc3ccc(C(F)(F)F)cc3)c3ncn([C@@H]4O[C@H](CO)[C@H](O)[C@H]4O)c3n2)c1Aglycone:
OCc1cnn(-c2nc3c(c(Nc4ccc(C(F)(F)F)cc4)n2)N=C[N]3)c1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 5 |
| HBD: | 5 | FractionCSP3: | 0.33 |
| AlogP: | 0.88 | Num_rotatable_bonds: | 6 |
| MolWt: | 507.43 | Num_heavy_atoms: | 36 |
| TPSA: | 163.6 | NumAromaticRings: | 4 |
Unique Aglycone
AD11746
Formula: C16H11ON7F3
Smiles:
OCc1cnn(-c2nc3c(c(Nc4ccc(C(F)(F)F)cc4)n2)N=C[N]3)c1| HBA: | 8 | RingCount: | 4 |
| HBD: | 2 | FractionCSP3: | 0.12 |
| AlogP: | 2.83 | Num_rotatable_bonds: | 4 |
| MolWt: | 374.31 | Num_heavy_atoms: | 27 |
| TPSA: | 102.32 | NumAromaticRings: | 3 |
