| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 28th, 2010 | 20 | Yes |
Popular Name: (1S)-1-(2,4-difluorophenyl)-2-[4-(2-hydroxyethyl)piperazin-1-yl]ethanol (1S)-1-(2,4-difluorophenyl)-2-[4…
| 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) | 0.67 | 1.23 | -35.27 | 3 | 4 | 1 | 48 | 287.33 | 5 | ↓ |
| Mid Mid (pH 6-8) | 0.67 | 1.1 | -40.15 | 3 | 4 | 1 | 48 | 287.33 | 5 | ↓ |
| Mid Mid (pH 6-8) | 0.67 | -1.12 | -7.38 | 2 | 4 | 0 | 47 | 286.322 | 5 | ↓ |
