| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 20th, 2009 | 23 | Yes |
Popular Name: (2R)-2-(4-fluorophenyl)-2-(4-methylpiperazin-1-yl)-1-piperazin-1-yl-ethanone (2R)-2-(4-fluorophenyl)-2-(4-met…
| 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) | 0.63 | 5.86 | -99.93 | 3 | 5 | 2 | 45 | 322.428 | 3 | ↓ |
| Hi High (pH 8-9.5) | 0.63 | 2.01 | -8.78 | 1 | 5 | 0 | 39 | 320.412 | 3 | ↓ |
| Mid Mid (pH 6-8) | 0.63 | 5.44 | -105.29 | 3 | 5 | 2 | 45 | 322.428 | 3 | ↓ |
| Mid Mid (pH 6-8) | 0.63 | 4.47 | -40.82 | 2 | 5 | 1 | 40 | 321.42 | 3 | ↓ |
| Mid Mid (pH 6-8) | 0.63 | 3.48 | -53.42 | 2 | 5 | 1 | 43 | 321.42 | 3 | ↓ |
