| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 17th, 2009 | 16 | Yes |
Popular Name: (2S)-2-(7-bromo-1,3-benzodioxol-5-yl)-2-(ethylamino)acetonitrile (2S)-2-(7-bromo-1,3-benzodioxol-…
| 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) | 2.47 | 3.71 | -8.84 | 1 | 4 | 0 | 54 | 283.125 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 2.47 | 4.81 | -52.94 | 2 | 4 | 1 | 59 | 284.133 | 3 | ↓ |
