Glycoside
GD003673
Name:
NoneFormula:
C10H11O6N2F2BrSmiles:
O=c1nc(OC(F)F)c(Br)cn1[C@@H]1O[C@H](CO)[C@H](O)[C@H]1OAglycone:
O=c1nc(OC(F)F)c(Br)c[nH]1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.6 |
| AlogP: | -0.78 | Num_rotatable_bonds: | 4 |
| MolWt: | 373.11 | Num_heavy_atoms: | 21 |
| TPSA: | 114.04 | NumAromaticRings: | 1 |
Unique Aglycone
AD03305
Formula: C5H3O2N2F2Br
Smiles:
O=c1nc(OC(F)F)c(Br)c[nH]1| HBA: | 4 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.2 |
| AlogP: | 1.13 | Num_rotatable_bonds: | 2 |
| MolWt: | 240.99 | Num_heavy_atoms: | 12 |
| TPSA: | 54.98 | NumAromaticRings: | 1 |
