| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 20th, 2009 | 17 | Yes |
Popular Name: (2S)-1-(4-fluorophenyl)-2-piperazin-1-yl-propan-1-one (2S)-1-(4-fluorophenyl)-2-pipera…
| 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) | 1.28 | 4.29 | -45.36 | 2 | 3 | 1 | 37 | 237.298 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.28 | 2.88 | -6.86 | 1 | 3 | 0 | 32 | 236.29 | 3 | ↓ |
| Mid Mid (pH 6-8) | 1.28 | 5.06 | -35.93 | 2 | 3 | 1 | 34 | 237.298 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 1.28 | 6.45 | -120.6 | 3 | 3 | 2 | 38 | 238.306 | 3 | ↓ |
