Glycoside
GD089383
Name:
NoneFormula:
C20H30O6N3FSmiles:
C[C@@H]1O[C@@H](OCCNC(=O)c2ccc(N3CCN(C)CC3)cc2F)[C@@H](O)[C@H](O)[C@@H]1OAglycone:
CN1CCN(c2ccc(C(=O)NCCO)c(F)c2)CC1Sugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.65 |
| AlogP: | -0.85 | Num_rotatable_bonds: | 6 |
| MolWt: | 427.47 | Num_heavy_atoms: | 30 |
| TPSA: | 114.73 | NumAromaticRings: | 1 |
Unique Aglycone
AD38992
Formula: C14H20O2N3F
Smiles:
CN1CCN(c2ccc(C(=O)NCCO)c(F)c2)CC1| HBA: | 5 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.5 |
| AlogP: | 0.3 | Num_rotatable_bonds: | 4 |
| MolWt: | 281.33 | Num_heavy_atoms: | 20 |
| TPSA: | 55.81 | NumAromaticRings: | 1 |
