In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 25th, 2008 | 19 | No |
Popular Name: 2-(4-aza-1-azoniabicyclo[2.2.2]octan-1-yl)-1-(4-methoxyphenyl)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) | -2.68 | 5.97 | -37.52 | 0 | 4 | 1 | 30 | 261.345 | 4 | ↓ |
Mid Mid (pH 6-8) | -2.68 | 8.5 | -112.12 | 1 | 4 | 2 | 31 | 262.353 | 4 | ↓ |