| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 17th, 2008 | 19 | Yes |
Popular Name: (2S)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(pentylamino)acetonitrile (2S)-2-(2,3-dihydro-1,4-benzodio…
| 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) | 2.92 | 5.86 | -8.89 | 1 | 4 | 0 | 54 | 260.337 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.92 | 7.12 | -53.32 | 2 | 4 | 1 | 59 | 261.345 | 6 | ↓ |
