| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 28th, 2010 | 25 | Yes |
Popular Name: (1S)-1-(1,3-benzodioxol-5-yl)-2-[4-(3-chlorophenyl)piperazin-1-yl]ethanol (1S)-1-(1,3-benzodioxol-5-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) | 3.29 | 5.04 | -9.1 | 1 | 5 | 0 | 45 | 360.841 | 4 | ↓ |
| Mid Mid (pH 6-8) | 3.29 | 7.25 | -50.75 | 2 | 5 | 1 | 46 | 361.849 | 4 | ↓ |
