| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 2nd, 2009 | 17 | Yes |
Popular Name: (2S)-2-(7-bromo-1,3-benzodioxol-5-yl)-2-(isopropylamino)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) | 2.77 | 4.18 | -8.8 | 1 | 4 | 0 | 54 | 297.152 | 3 | ↓ |
| Mid Mid (pH 6-8) | 2.77 | 5.31 | -49.24 | 2 | 4 | 1 | 59 | 298.16 | 3 | ↓ |
