Glycoside
GD103482
Name:
NoneFormula:
C19H30O4N6FSSmiles:
CC[NH+](CC)CCCNC(=S)Nc1ncnc2c1c(F)cn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1OAglycone:
CC[NH+](CC)CCCNC(=S)Nc1ncnc2c1C(F)=C[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.63 |
| AlogP: | -1.22 | Num_rotatable_bonds: | 9 |
| MolWt: | 457.55 | Num_heavy_atoms: | 31 |
| TPSA: | 129.13 | NumAromaticRings: | 2 |
Unique Aglycone
AD43820
Formula: C14H21N6FS
Smiles:
CC[NH+](CC)CCCNC(=S)Nc1ncnc2c1C(F)=C[N]2| HBA: | 6 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.5 |
| AlogP: | 0.6 | Num_rotatable_bonds: | 7 |
| MolWt: | 324.43 | Num_heavy_atoms: | 22 |
| TPSA: | 68.38 | NumAromaticRings: | 1 |
