Glycoside
GD070111
Name:
NoneFormula:
C16H21O4N4FSmiles:
CCC/C=C/Nc1ncnc2c1c(F)cn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1OAglycone:
CCCC=CNc1ncnc2c1C(F)=C[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.5 |
| AlogP: | 0.91 | Num_rotatable_bonds: | 6 |
| MolWt: | 352.37 | Num_heavy_atoms: | 25 |
| TPSA: | 112.66 | NumAromaticRings: | 2 |
Unique Aglycone
AD33206
Formula: C11H12N4F
Smiles:
CCCC=CNc1ncnc2c1C(F)=C[N]2| HBA: | 4 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.27 |
| AlogP: | 2.72 | Num_rotatable_bonds: | 4 |
| MolWt: | 219.24 | Num_heavy_atoms: | 16 |
| TPSA: | 51.91 | NumAromaticRings: | 1 |
