| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 18th, 2011 | 22 | No |
Popular Name: 1-oxido-N-[2-(2,2,2-trifluoroethylamino)phenyl]pyridin-1-ium-2-carboxamide 1-oxido-N-[2-(2,2,2-trifluoroeth…
None
| Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
|---|---|---|---|---|---|---|---|---|---|---|
| Ref Reference (pH 7) | 0.98 | 6.89 | -34.06 | 2 | 5 | 0 | 67 | 311.263 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.05 | 5.43 | -73.17 | 1 | 5 | -1 | 73 | 310.255 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
