| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 8th, 2008 | 22 | Yes |
Popular Name: 2-[(2S)-4-[(2,4-difluorophenyl)methyl]-1-isobutyl-piperazin-2-yl]ethanol 2-[(2S)-4-[(2,4-difluorophenyl)m…
| 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) | 2.64 | 5.32 | -34.07 | 2 | 3 | 1 | 28 | 313.412 | 6 | ↓ |
| Hi High (pH 8-9.5) | 2.64 | 3.35 | -6.6 | 1 | 3 | 0 | 27 | 312.404 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.64 | 5.73 | -46.5 | 2 | 3 | 1 | 28 | 313.412 | 6 | ↓ |
