| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 2nd, 2009 | 17 | Yes |
Popular Name: (2S)-2-(7-chloro-1,3-benzodioxol-5-yl)-2-(propylamino)acetonitrile (2S)-2-(7-chloro-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) | 2.84 | 4.38 | -8.85 | 1 | 4 | 0 | 54 | 252.701 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 2.84 | 5.45 | -54.24 | 2 | 4 | 1 | 59 | 253.709 | 4 | ↓ |
