Glycoside
GD017343
Name:
NoneFormula:
C14H15O4N6FSSmiles:
Nc1nc(OCc2nccs2)nc2c1ncn2[C@@H]1O[C@H](CF)[C@H](O)[C@H]1OAglycone:
Nc1nc(OCc2nccs2)nc2c1N=C[N]2Sugarmoiety:
OC1OC(CF)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.43 |
| AlogP: | 0.03 | Num_rotatable_bonds: | 5 |
| MolWt: | 382.38 | Num_heavy_atoms: | 26 |
| TPSA: | 141.43 | NumAromaticRings: | 3 |
Unique Aglycone
AD12381
Formula: C9H7ON6S
Smiles:
Nc1nc(OCc2nccs2)nc2c1N=C[N]2| HBA: | 7 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.11 |
| AlogP: | 1.0 | Num_rotatable_bonds: | 3 |
| MolWt: | 247.26 | Num_heavy_atoms: | 17 |
| TPSA: | 100.38 | NumAromaticRings: | 2 |
