| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 20th, 2009 | 18 | Yes |
Popular Name: [(3R)-3-[(2S)-2-ethyl-1-piperidyl]quinuclidin-3-yl]methanamine [(3R)-3-[(2S)-2-ethyl-1-piperidy…
| 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) | 1.64 | 4.78 | -107.36 | 4 | 3 | 2 | 35 | 253.434 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.64 | 4.93 | -33.5 | 3 | 3 | 1 | 34 | 252.426 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.64 | 2.35 | -41.23 | 3 | 3 | 1 | 34 | 252.426 | 3 | ↓ |
| Mid Mid (pH 6-8) | 1.64 | 6.1 | -93.04 | 4 | 3 | 2 | 35 | 253.434 | 3 | ↓ |
| Mid Mid (pH 6-8) | 1.64 | 3.82 | -113.75 | 4 | 3 | 2 | 35 | 253.434 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 1.64 | 6.26 | -211.39 | 5 | 3 | 3 | 37 | 254.442 | 3 | ↓ |
