| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 29th, 2010 | 17 | Yes |
Popular Name: 3-[[2-cyanoethyl(ethyl)amino]methyl]-4-fluoro-benzonitrile 3-[[2-cyanoethyl(ethyl)amino]met…
| 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) | 1.42 | 6.54 | -9.72 | 0 | 3 | 0 | 51 | 231.274 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 1.42 | 8.19 | -54.96 | 1 | 3 | 1 | 52 | 232.282 | 5 | ↓ |
