Glycoside
GD104129
Name:
NoneFormula:
C16H22O4N5F3S2Smiles:
CSCCNc1nc(SCCC(F)(F)F)nc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1OAglycone:
CSCCNc1nc(SCCC(F)(F)F)nc2c1N=C[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.69 |
| AlogP: | 1.26 | Num_rotatable_bonds: | 9 |
| MolWt: | 469.51 | Num_heavy_atoms: | 30 |
| TPSA: | 125.55 | NumAromaticRings: | 2 |
Unique Aglycone
AD13407
Formula: C11H13N5F3S2
Smiles:
CSCCNc1nc(SCCC(F)(F)F)nc2c1N=C[N]2| HBA: | 5 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.55 |
| AlogP: | 3.21 | Num_rotatable_bonds: | 7 |
| MolWt: | 336.39 | Num_heavy_atoms: | 21 |
| TPSA: | 64.27 | NumAromaticRings: | 1 |
