| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 5th, 2008 | 28 | Yes |
Popular Name: (2S)-1-(4-ethylpiperazin-1-yl)-2-[4-(4-fluorophenyl)sulfonylpiperazin-1-yl]propan-1-one (2S)-1-(4-ethylpiperazin-1-yl)-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) | 1.25 | 5.24 | -47.15 | 1 | 7 | 1 | 65 | 413.539 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.25 | 3.07 | -12.27 | 0 | 7 | 0 | 64 | 412.531 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.25 | 5.49 | -48.96 | 1 | 7 | 1 | 65 | 413.539 | 5 | ↓ |
