| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 20th, 2010 | 21 | Yes |
Popular Name: 1-[(2S)-2-(4-ethylphenyl)-2-(methylamino)ethyl]-N,N-dimethyl-piperidin-4-amine 1-[(2S)-2-(4-ethylphenyl)-2-(met…
| 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) | 3.04 | 9.05 | -89.28 | 3 | 3 | 2 | 24 | 291.483 | 6 | ↓ |
| Hi High (pH 8-9.5) | 3.04 | 7.26 | -36.7 | 2 | 3 | 1 | 20 | 290.475 | 6 | ↓ |
| Hi High (pH 8-9.5) | 3.04 | 8.03 | -34.64 | 2 | 3 | 1 | 20 | 290.475 | 6 | ↓ |
| Mid Mid (pH 6-8) | 3.04 | 9.87 | -102.85 | 3 | 3 | 2 | 21 | 291.483 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 3.04 | 10.93 | -209.24 | 4 | 3 | 3 | 25 | 292.491 | 6 | ↓ |
