Glycoside
GD081157
Name:
NoneFormula:
C15H18O5N5F3Smiles:
OC[C@H]1O[C@@H](n2cnc3c(N4CC[C@](O)(C(F)(F)F)C4)ncnc32)[C@H](O)[C@@H]1OAglycone:
OC1(C(F)(F)F)CCN(c2ncnc3c2N=C[N]3)C1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.67 |
| AlogP: | -1.06 | Num_rotatable_bonds: | 3 |
| MolWt: | 405.33 | Num_heavy_atoms: | 28 |
| TPSA: | 136.99 | NumAromaticRings: | 2 |
Unique Aglycone
AD36597
Formula: C10H9ON5F3
Smiles:
OC1(C(F)(F)F)CCN(c2ncnc3c2N=C[N]3)C1| HBA: | 6 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.5 |
| AlogP: | 0.89 | Num_rotatable_bonds: | 1 |
| MolWt: | 272.21 | Num_heavy_atoms: | 19 |
| TPSA: | 75.71 | NumAromaticRings: | 1 |
