| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 20th, 2010 | 17 | Yes |
Popular Name: (2S)-3-[(2R)-1,4-dioxan-2-yl]-3-oxo-2-(2-pyridyl)propanenitrile (2S)-3-[(2R)-1,4-dioxan-2-yl]-3-…
| 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) | -0.68 | 4.07 | -10.57 | 0 | 5 | 0 | 72 | 232.239 | 3 | ↓ |
