| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 13th, 2010 | 28 | Yes |
Popular Name: (1S)-1-(1,3-benzodioxol-5-yl)-2-[4-[2-(4-chlorophenoxy)ethyl]piperazin-1-yl]ethanol (1S)-1-(1,3-benzodioxol-5-yl)-2-…
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| 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) | 3.30 | 6.15 | -45.5 | 2 | 6 | 1 | 56 | 405.902 | 7 | ↓ |
| Mid Mid (pH 6-8) | 3.30 | 3.86 | -9.49 | 1 | 6 | 0 | 54 | 404.894 | 7 | ↓ |
| Mid Mid (pH 6-8) | 3.30 | 6.11 | -46.82 | 2 | 6 | 1 | 56 | 405.902 | 7 | ↓ |
