In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 18th, 2010 | 17 | No |
Popular Name: 2-(4-aza-1-azoniabicyclo[2.2.2]octan-1-yl)-1-(3-bromo-2-thienyl)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) | -2.10 | 6.43 | -36.33 | 0 | 3 | 1 | 20 | 316.244 | 3 | ↓ |
Mid Mid (pH 6-8) | -2.10 | 8.93 | -109.23 | 1 | 3 | 2 | 22 | 317.252 | 3 | ↓ |