Glycoside
GD099059
Name:
NoneFormula:
C18H29O4N7FSSmiles:
CC[NH+](CC)CCCNC(=S)Nc1nc(F)nc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@@H]1OAglycone:
CC[NH+](CC)CCCNC(=S)Nc1nc(F)nc2c1N=C[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.67 |
| AlogP: | -1.82 | Num_rotatable_bonds: | 9 |
| MolWt: | 458.54 | Num_heavy_atoms: | 31 |
| TPSA: | 142.02 | NumAromaticRings: | 2 |
Unique Aglycone
AD42169
Formula: C13H20N7FS
Smiles:
CC[NH+](CC)CCCNC(=S)Nc1nc(F)nc2c1N=C[N]2| HBA: | 7 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.54 |
| AlogP: | 0.13 | Num_rotatable_bonds: | 7 |
| MolWt: | 325.42 | Num_heavy_atoms: | 22 |
| TPSA: | 80.74 | NumAromaticRings: | 1 |
