| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 25th, 2010 | 18 | Yes |
Popular Name: (3S,5S)-3,5-dimethyl-1-(2-methylsulfonylphenyl)piperazine (3S,5S)-3,5-dimethyl-1-(2-methyl…
| 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) | 1.61 | 4.83 | -40.6 | 2 | 4 | 1 | 54 | 269.39 | 2 | ↓ |
| Hi High (pH 8-9.5) | 1.61 | 2.87 | -8.67 | 1 | 4 | 0 | 49 | 268.382 | 2 | ↓ |
