| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 18th, 2009 | 14 | Yes |
Popular Name: (2R)-3-[4-(2-hydroxyethyl)piperazin-1-yl]-2-methyl-propanenitrile (2R)-3-[4-(2-hydroxyethyl)pipera…
| 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) | 0.13 | -0.45 | -8.26 | 1 | 4 | 0 | 50 | 197.282 | 4 | ↓ |
| Mid Mid (pH 6-8) | 0.13 | 1.94 | -39.44 | 2 | 4 | 1 | 52 | 198.29 | 4 | ↓ |
| Mid Mid (pH 6-8) | 0.13 | 1.59 | -47.79 | 2 | 4 | 1 | 52 | 198.29 | 4 | ↓ |
