| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 19th, 2010 | 22 | Yes |
Popular Name: 4-[[2-(1,3-benzodioxol-5-yloxy)ethylamino]methyl]benzonitrile 4-[[2-(1,3-benzodioxol-5-yloxy)e…
| 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) | 2.82 | 6.97 | -60.66 | 2 | 5 | 1 | 68 | 297.334 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.82 | 5.56 | -11.33 | 1 | 5 | 0 | 64 | 296.326 | 6 | ↓ |
