Glycoside
GD036268
Name:
NoneFormula:
C16H15O4N5F2Smiles:
Nc1ncnc2c1ncn2[C@@H]1O[C@H]([C@H](O)c2ccc(F)c(F)c2)[C@H](O)[C@H]1OAglycone:
Nc1ncnc2c1N=C[N]2.OCc1ccc(F)c(F)c1Sugarmoiety:
OC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.31 |
| AlogP: | 0.04 | Num_rotatable_bonds: | 3 |
| MolWt: | 379.32 | Num_heavy_atoms: | 27 |
| TPSA: | 139.54 | NumAromaticRings: | 3 |
Unique Aglycone
AD00058
Formula: C5H4N5
Smiles:
Nc1ncnc2c1N=C[N]2| HBA: | 5 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | -0.03 | Num_rotatable_bonds: | 0 |
| MolWt: | 134.12 | Num_heavy_atoms: | 10 |
| TPSA: | 78.26 | NumAromaticRings: | 1 |
AD06982
Formula: C7H6OF2
Smiles:
OCc1ccc(F)c(F)c1| HBA: | 1 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.14 |
| AlogP: | 1.46 | Num_rotatable_bonds: | 1 |
| MolWt: | 144.12 | Num_heavy_atoms: | 10 |
| TPSA: | 20.23 | NumAromaticRings: | 1 |
