| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 24th, 2009 | 20 | Yes |
Popular Name: (2S)-1-(4-tert-butylphenyl)-2-piperazin-1-yl-propan-1-one (2S)-1-(4-tert-butylphenyl)-2-pi…
| 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) | 2.82 | 6.56 | -43.81 | 2 | 3 | 1 | 37 | 275.416 | 4 | ↓ |
| Hi High (pH 8-9.5) | 2.82 | 5.14 | -6.83 | 1 | 3 | 0 | 32 | 274.408 | 4 | ↓ |
| Mid Mid (pH 6-8) | 2.82 | 7.32 | -32.63 | 2 | 3 | 1 | 34 | 275.416 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 2.82 | 8.72 | -116.33 | 3 | 3 | 2 | 38 | 276.424 | 4 | ↓ |
