| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 17th, 2010 | 18 | Yes |
Popular Name: (2S)-3,3-dimethyl-2-[4-(2,2,2-trifluoroethyl)piperazin-1-yl]butan-1-amine (2S)-3,3-dimethyl-2-[4-(2,2,2-tr…
| 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) | 1.65 | 2 | -42.87 | 3 | 3 | 1 | 34 | 268.347 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.65 | 4.14 | -110.9 | 4 | 3 | 2 | 35 | 269.355 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 1.65 | 2.84 | -125.86 | 4 | 3 | 2 | 35 | 269.355 | 5 | ↓ |
