Glycoside
GD030565
Name:
NoneFormula:
C12H13O6N2F2BrSmiles:
O=c1nc(OC(F)F)c(C=CBr)cn1C1O[C@H](CO)[C@H](O)[C@H]1OAglycone:
O=c1nc(OC(F)F)c(C=CBr)c[nH]1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.5 |
| AlogP: | -0.18 | Num_rotatable_bonds: | 5 |
| MolWt: | 399.14 | Num_heavy_atoms: | 23 |
| TPSA: | 114.04 | NumAromaticRings: | 1 |
Unique Aglycone
AD19772
Formula: C7H5O2N2F2Br
Smiles:
O=c1nc(OC(F)F)c(C=CBr)c[nH]1| HBA: | 4 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.14 |
| AlogP: | 1.74 | Num_rotatable_bonds: | 3 |
| MolWt: | 267.03 | Num_heavy_atoms: | 14 |
| TPSA: | 54.98 | NumAromaticRings: | 1 |
