| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 11th, 2008 | 18 | Yes |
Popular Name: (2S)-1-(4-ethylphenyl)-2-piperazin-1-yl-propan-1-one (2S)-1-(4-ethylphenyl)-2-piperaz…
| 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) | 2.03 | 5.65 | -44.04 | 2 | 3 | 1 | 37 | 247.362 | 4 | ↓ |
| Hi High (pH 8-9.5) | 2.03 | 4.23 | -7.18 | 1 | 3 | 0 | 32 | 246.354 | 4 | ↓ |
| Mid Mid (pH 6-8) | 2.03 | 6.41 | -32.7 | 2 | 3 | 1 | 34 | 247.362 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 2.03 | 7.81 | -116.24 | 3 | 3 | 2 | 38 | 248.37 | 4 | ↓ |
