| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 2nd, 2008 | 19 | Yes |
Popular Name: 3-fluoro-4-[(4-propylpiperazin-1-yl)methyl]benzonitrile 3-fluoro-4-[(4-propylpiperazin-1…
| 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) | 2.36 | 7.83 | -40.81 | 1 | 3 | 1 | 31 | 262.352 | 4 | ↓ |
| Mid Mid (pH 6-8) | 2.36 | 7.87 | -42.49 | 1 | 3 | 1 | 31 | 262.352 | 4 | ↓ |
| Mid Mid (pH 6-8) | 2.36 | 5.52 | -5.77 | 0 | 3 | 0 | 30 | 261.344 | 4 | ↓ |
