Glycoside
GD090929
Name:
NoneFormula:
C17H23O4N6F3Smiles:
OC[C@H]1O[C@@H](n2cnc3c(NC4CCN(CC(F)(F)F)CC4)ncnc32)[C@H](O)[C@@H]1OAglycone:
FC(F)(F)CN1CCC(Nc2ncnc3c2N=C[N]3)CC1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.71 |
| AlogP: | -0.12 | Num_rotatable_bonds: | 5 |
| MolWt: | 432.4 | Num_heavy_atoms: | 30 |
| TPSA: | 128.79 | NumAromaticRings: | 2 |
Unique Aglycone
AD39590
Formula: C12H14N6F3
Smiles:
FC(F)(F)CN1CCC(Nc2ncnc3c2N=C[N]3)CC1| HBA: | 6 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.58 |
| AlogP: | 1.82 | Num_rotatable_bonds: | 3 |
| MolWt: | 299.28 | Num_heavy_atoms: | 21 |
| TPSA: | 67.51 | NumAromaticRings: | 1 |
