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-fluorophenyl)-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) | -2.57 | -0.46 | -38.6 | 0 | 3 | 1 | 20 | 249.309 | 3 | ↓ |
Mid Mid (pH 6-8) | -2.57 | 2.88 | -114 | 1 | 3 | 2 | 21 | 250.317 | 3 | ↓ |