Glycoside
GD008397
Name:
NoneFormula:
C16H15O8N3F2Smiles:
O=C(O[C@@H]1O[C@H](C(=O)O)[C@H](O)[C@H](O)[C@H]1O)c1cn(Cc2c(F)cccc2F)nn1Aglycone:
O=C(O)c1cn(Cc2c(F)cccc2F)nn1Sugarmoiety:
O=C(O)C1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.38 |
| AlogP: | -1.35 | Num_rotatable_bonds: | 5 |
| MolWt: | 415.31 | Num_heavy_atoms: | 29 |
| TPSA: | 164.23 | NumAromaticRings: | 2 |
Unique Aglycone
AD06708
Formula: C10H7O2N3F2
Smiles:
O=C(O)c1cn(Cc2c(F)cccc2F)nn1| HBA: | 5 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.1 |
| AlogP: | 1.3 | Num_rotatable_bonds: | 3 |
| MolWt: | 239.18 | Num_heavy_atoms: | 17 |
| TPSA: | 68.01 | NumAromaticRings: | 2 |
