Glycoside
GD036086
Name:
NoneFormula:
C17H16O3N4FISmiles:
C[C@@H]1O[C@H](n2cc(I)c3c(Nc4ccc(F)cc4)ncnc32)[C@H](O)[C@H]1OAglycone:
Fc1ccc(Nc2ncnc3c2C(I)=C[N]3)cc1Sugarmoiety:
CC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 4 |
| HBD: | 3 | FractionCSP3: | 0.29 |
| AlogP: | 2.56 | Num_rotatable_bonds: | 3 |
| MolWt: | 470.24 | Num_heavy_atoms: | 26 |
| TPSA: | 92.43 | NumAromaticRings: | 3 |
Unique Aglycone
AD22794
Formula: C12H7N4FI
Smiles:
Fc1ccc(Nc2ncnc3c2C(I)=C[N]3)cc1| HBA: | 4 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.0 |
| AlogP: | 3.34 | Num_rotatable_bonds: | 2 |
| MolWt: | 353.12 | Num_heavy_atoms: | 18 |
| TPSA: | 51.91 | NumAromaticRings: | 2 |
