Glycoside
GD101757
Name:
NoneFormula:
C22H27O7N2FSmiles:
OC[C@H]1O[C@@H](Oc2ccc(Nc3cc(F)cc(N4CCOCC4)c3)cc2)[C@H](O)[C@@H](O)[C@H]1OAglycone:
Oc1ccc(Nc2cc(F)cc(N3CCOCC3)c2)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.45 |
| AlogP: | 0.58 | Num_rotatable_bonds: | 6 |
| MolWt: | 450.46 | Num_heavy_atoms: | 32 |
| TPSA: | 123.88 | NumAromaticRings: | 2 |
Unique Aglycone
AD43092
Formula: C16H17O2N2F
Smiles:
Oc1ccc(Nc2cc(F)cc(N3CCOCC3)c2)cc1| HBA: | 4 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.25 |
| AlogP: | 3.11 | Num_rotatable_bonds: | 3 |
| MolWt: | 288.32 | Num_heavy_atoms: | 21 |
| TPSA: | 44.73 | NumAromaticRings: | 2 |
