| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 18th, 2009 | 21 | Yes |
Popular Name: (2S,4R)-2-ethyl-4-methyl-2-[4-(2,2,2-trifluoroethyl)piperazin-1-yl]hexan-1-amine (2S,4R)-2-ethyl-4-methyl-2-[4-(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) | 2.80 | 3.71 | -46.06 | 3 | 3 | 1 | 34 | 310.428 | 8 | ↓ |
| Mid Mid (pH 6-8) | 2.80 | 5.55 | -118.71 | 4 | 3 | 2 | 35 | 311.436 | 8 | ↓ |
| Mid Mid (pH 6-8) | 2.80 | 5.87 | -105.3 | 4 | 3 | 2 | 35 | 311.436 | 8 | ↓ |
