| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 20th, 2011 | 18 | Yes |
Popular Name: (2S)-2-(4-ethyl-4-methyl-1-piperidyl)-2-(4-pyridyl)ethanamine (2S)-2-(4-ethyl-4-methyl-1-piper…
| 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) | 1.34 | 3.88 | -47.22 | 3 | 3 | 1 | 44 | 248.394 | 4 | ↓ |
| Hi High (pH 8-9.5) | 1.34 | 3.8 | -3.04 | 2 | 3 | 0 | 42 | 247.386 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.34 | 6.13 | -33.83 | 3 | 3 | 1 | 43 | 248.394 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.34 | 5.83 | -126.93 | 4 | 3 | 2 | 45 | 249.402 | 4 | ↓ |
