| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 29th, 2010 | 21 | Yes |
Popular Name: (1S,2S,4R)-2-[2-cyanoethyl(ethyl)amino]-4-phenyl-cyclohexanecarbonitrile (1S,2S,4R)-2-[2-cyanoethyl(ethyl…
| 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) | 3.06 | 9.57 | -13.1 | 0 | 3 | 0 | 51 | 281.403 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.06 | 11.02 | -65.96 | 1 | 3 | 1 | 52 | 282.411 | 5 | ↓ |
