| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 7th, 2006 | 18 | No |
Popular Name: 2-(4-aza-1-azoniabicyclo[2.2.2]oct-1-yl)-1-(4-bromophenyl)-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) | -1.93 | -1.96 | -38.03 | 0 | 3 | 1 | 20 | 310.215 | 3 | ↓ |
| Mid Mid (pH 6-8) | -1.93 | 1.39 | -113.55 | 1 | 3 | 2 | 21 | 311.223 | 3 | ↓ |
