| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 7th, 2009 | 20 | No |
Popular Name: 2-(4-aza-1-azoniabicyclo[2.2.2]octan-1-yl)-1-(3-nitrophenyl)ethanone 2-(4-aza-1-azoniabicyclo[2.2.2]o…
| 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) | -2.80 | 7.34 | -52.31 | 0 | 6 | 1 | 66 | 276.316 | 4 | ↓ |
| Mid Mid (pH 6-8) | -2.80 | 9.87 | -128.39 | 1 | 6 | 2 | 67 | 277.324 | 4 | ↓ |
