Glycoside
GD036533
Name:
NoneFormula:
C24H23O7N6FSSmiles:
O=C(NCc1ccc(Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@H](O)[C@H]2O)cc1)c1ccc(S(=O)(=O)F)cc1Aglycone:
O=C(NCc1ccc(Nc2ncnc3c2N=C[N]3)cc1)c1ccc(S(=O)(=O)F)cc1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 5 |
| HBD: | 5 | FractionCSP3: | 0.25 |
| AlogP: | 0.77 | Num_rotatable_bonds: | 8 |
| MolWt: | 558.55 | Num_heavy_atoms: | 39 |
| TPSA: | 188.79 | NumAromaticRings: | 4 |
Unique Aglycone
AD23029
Formula: C19H14O3N6FS
Smiles:
O=C(NCc1ccc(Nc2ncnc3c2N=C[N]3)cc1)c1ccc(S(=O)(=O)F)cc1| HBA: | 9 | RingCount: | 4 |
| HBD: | 2 | FractionCSP3: | 0.05 |
| AlogP: | 2.72 | Num_rotatable_bonds: | 6 |
| MolWt: | 425.43 | Num_heavy_atoms: | 30 |
| TPSA: | 127.51 | NumAromaticRings: | 3 |
