| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 20th, 2010 | 21 | Yes |
Popular Name: 1-[(2S)-2-(3,4-dimethylphenyl)-2-(methylamino)ethyl]-N,N-dimethyl-piperidin-4-amine 1-[(2S)-2-(3,4-dimethylphenyl)-2…
| 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) | 2.95 | 8.83 | -89.27 | 3 | 3 | 2 | 24 | 291.483 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.95 | 7.04 | -36.86 | 2 | 3 | 1 | 20 | 290.475 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.95 | 7.82 | -34.93 | 2 | 3 | 1 | 20 | 290.475 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.95 | 9.65 | -103 | 3 | 3 | 2 | 21 | 291.483 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 2.95 | 10.71 | -209.61 | 4 | 3 | 3 | 25 | 292.491 | 5 | ↓ |
