| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 15th, 2009 | 17 | Yes |
Popular Name: 3-[(8-chloro-2,3-dihydro-1,4-benzodioxin-6-yl)methylamino]propanenitrile 3-[(8-chloro-2,3-dihydro-1,4-ben…
| 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) | 1.26 | 4.09 | -10.44 | 1 | 4 | 0 | 54 | 252.701 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.26 | 5.45 | -61.82 | 2 | 4 | 1 | 59 | 253.709 | 4 | ↓ |
