| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 29th, 2010 | 18 | Yes |
Popular Name: [(3S)-3-(4-ethyl-1-piperidyl)quinuclidin-3-yl]methanamine [(3S)-3-(4-ethyl-1-piperidyl)qui…
| 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) | 1.70 | 4.5 | -112.8 | 4 | 3 | 2 | 35 | 253.434 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.70 | 2.51 | -0.52 | 2 | 3 | 0 | 32 | 251.418 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.70 | 4.94 | -33.18 | 3 | 3 | 1 | 34 | 252.426 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.70 | 2.54 | -44.72 | 3 | 3 | 1 | 34 | 252.426 | 3 | ↓ |
| Mid Mid (pH 6-8) | 1.70 | 6.77 | -96.39 | 4 | 3 | 2 | 35 | 253.434 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 1.70 | 6.93 | -219.48 | 5 | 3 | 3 | 37 | 254.442 | 3 | ↓ |
