Glycoside
GD011773
Name:
NoneFormula:
C21H25O6N6FSmiles:
O=C(NCCOCCNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@H](O)[C@H]1O)c1cccc(F)c1Aglycone:
O=C(NCCOCCNc1ncnc2c1N=C[N]2)c1cccc(F)c1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.43 |
| AlogP: | -0.56 | Num_rotatable_bonds: | 10 |
| MolWt: | 476.47 | Num_heavy_atoms: | 34 |
| TPSA: | 163.88 | NumAromaticRings: | 3 |
Unique Aglycone
AD08953
Formula: C16H16O2N6F
Smiles:
O=C(NCCOCCNc1ncnc2c1N=C[N]2)c1cccc(F)c1| HBA: | 8 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.25 |
| AlogP: | 1.38 | Num_rotatable_bonds: | 8 |
| MolWt: | 343.34 | Num_heavy_atoms: | 25 |
| TPSA: | 102.6 | NumAromaticRings: | 2 |
