| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 2nd, 2009 | 14 | Yes |
Popular Name: (2S,4R)-2-ethyl-2-(isopropylamino)-4-methyl-hexanenitrile (2S,4R)-2-ethyl-2-(isopropylamin…
| 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) | 3.39 | 5.27 | -3.66 | 1 | 2 | 0 | 36 | 196.338 | 6 | ↓ |
| Mid Mid (pH 6-8) | 3.39 | 6.04 | -40.13 | 2 | 2 | 1 | 40 | 197.346 | 6 | ↓ |
