Glycoside
GD090722
Name:
NoneFormula:
C17H22O5N5F3Smiles:
CO[C@]1(C(F)(F)F)CCCN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1Aglycone:
COC1(C(F)(F)F)CCCN(c2ncnc3c2N=C[N]3)C1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 3 | FractionCSP3: | 0.71 |
| AlogP: | -0.01 | Num_rotatable_bonds: | 4 |
| MolWt: | 433.39 | Num_heavy_atoms: | 30 |
| TPSA: | 125.99 | NumAromaticRings: | 2 |
Unique Aglycone
AD39491
Formula: C12H13ON5F3
Smiles:
COC1(C(F)(F)F)CCCN(c2ncnc3c2N=C[N]3)C1| HBA: | 6 | RingCount: | 3 |
| HBD: | 0 | FractionCSP3: | 0.58 |
| AlogP: | 1.93 | Num_rotatable_bonds: | 2 |
| MolWt: | 300.26 | Num_heavy_atoms: | 21 |
| TPSA: | 64.71 | NumAromaticRings: | 1 |
