| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 20th, 2011 | 18 | Yes |
Popular Name: (2S)-2-(4-ethyl-4-methyl-1-piperidyl)-2-(1-methylpyrazol-4-yl)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) | 1.00 | 3.26 | -46.8 | 3 | 4 | 1 | 49 | 251.398 | 4 | ↓ |
| Hi High (pH 8-9.5) | 1.00 | 3.18 | -5.47 | 2 | 4 | 0 | 47 | 250.39 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.00 | 5.29 | -121.19 | 4 | 4 | 2 | 50 | 252.406 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.00 | 4.95 | -35.63 | 3 | 4 | 1 | 48 | 251.398 | 4 | ↓ |
