| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 24th, 2010 | 25 | Yes |
Popular Name: (1S)-1-(1,3-benzodioxol-5-yl)-2-[4-(2-pyridylmethyl)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) | 1.17 | 4.43 | -40.95 | 2 | 6 | 1 | 59 | 342.419 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.17 | 2.14 | -10.55 | 1 | 6 | 0 | 58 | 341.411 | 5 | ↓ |
