| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 13th, 2010 | 21 | Yes |
Popular Name: 3-[(6-amino-4H-1,3-benzodioxin-8-yl)methyl-isobutyl-amino]propanenitrile 3-[(6-amino-4H-1,3-benzodioxin-8…
| 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) | 1.11 | 6 | -45.44 | 3 | 5 | 1 | 73 | 290.387 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.11 | 5.02 | -7.82 | 2 | 5 | 0 | 72 | 289.379 | 6 | ↓ |
