Glycoside
GD026494
Name:
NoneFormula:
C15H18O4N6F2Smiles:
Nc1ncnc2c1ncn2[C@@H]1O[C@H](C(=O)N2CCC(F)(F)CC2)[C@H](O)[C@H]1OAglycone:
Nc1ncnc2c1N=C[N]2.O=CN1CCC(F)(F)CC1Sugarmoiety:
OC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.6 |
| AlogP: | -0.71 | Num_rotatable_bonds: | 2 |
| MolWt: | 384.34 | Num_heavy_atoms: | 27 |
| TPSA: | 139.62 | NumAromaticRings: | 2 |
Unique Aglycone
AD00058
Formula: C5H4N5
Smiles:
Nc1ncnc2c1N=C[N]2| HBA: | 5 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | -0.03 | Num_rotatable_bonds: | 0 |
| MolWt: | 134.12 | Num_heavy_atoms: | 10 |
| TPSA: | 78.26 | NumAromaticRings: | 1 |
AD17457
Formula: C6H9ONF2
Smiles:
O=CN1CCC(F)(F)CC1| HBA: | 2 | RingCount: | 1 |
| HBD: | 0 | FractionCSP3: | 0.83 |
| AlogP: | 0.87 | Num_rotatable_bonds: | 1 |
| MolWt: | 149.14 | Num_heavy_atoms: | 10 |
| TPSA: | 20.31 | NumAromaticRings: | 0 |
