Glycoside
GD078160
Name:
NoneFormula:
C17H17O5N4FSmiles:
OC[C@H]1O[C@@H](n2cc(F)c3c(Nc4cccc(O)c4)ncnc32)[C@H](O)[C@@H]1OAglycone:
Oc1cccc(Nc2ncnc3c2C(F)=C[N]3)c1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.29 |
| AlogP: | 0.63 | Num_rotatable_bonds: | 4 |
| MolWt: | 376.34 | Num_heavy_atoms: | 27 |
| TPSA: | 132.89 | NumAromaticRings: | 3 |
Unique Aglycone
AD35842
Formula: C12H8ON4F
Smiles:
Oc1cccc(Nc2ncnc3c2C(F)=C[N]3)c1| HBA: | 5 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 2.44 | Num_rotatable_bonds: | 2 |
| MolWt: | 243.22 | Num_heavy_atoms: | 18 |
| TPSA: | 72.14 | NumAromaticRings: | 2 |
