| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 7th, 2009 | 19 | Yes |
Popular Name: 3-[4-[(2-chloro-6-fluoro-phenyl)methyl]piperazin-1-yl]propanenitrile 3-[4-[(2-chloro-6-fluoro-phenyl)…
None
| 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) | 1.84 | 7.46 | -38.23 | 1 | 3 | 1 | 31 | 282.77 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.84 | 7.21 | -47.84 | 1 | 3 | 1 | 31 | 282.77 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.84 | 5.13 | -7.81 | 0 | 3 | 0 | 30 | 281.762 | 4 | ↓ |
