Glycoside
GD000568
Name:
NoneFormula:
C21H24O6N6F2Smiles:
O=C(NCCOCCNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@H](O)[C@H]1O)c1ccc(F)c(F)c1Aglycone:
O=C(NCCOCCNc1ncnc2c1N=C[N]2)c1ccc(F)c(F)c1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.43 |
| AlogP: | -0.43 | Num_rotatable_bonds: | 10 |
| MolWt: | 494.46 | Num_heavy_atoms: | 35 |
| TPSA: | 163.88 | NumAromaticRings: | 3 |
Unique Aglycone
AD00619
Formula: C16H15O2N6F2
Smiles:
O=C(NCCOCCNc1ncnc2c1N=C[N]2)c1ccc(F)c(F)c1| HBA: | 8 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.25 |
| AlogP: | 1.52 | Num_rotatable_bonds: | 8 |
| MolWt: | 361.33 | Num_heavy_atoms: | 26 |
| TPSA: | 102.6 | NumAromaticRings: | 2 |
