| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 24th, 2009 | 20 | Yes |
Popular Name: 2-fluoro-6-[[2-(4-methylpiperazin-1-yl)-2-oxo-ethyl]amino]benzonitrile 2-fluoro-6-[[2-(4-methylpiperazi…
| 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) | 0.86 | 3.62 | -17.51 | 1 | 5 | 0 | 59 | 276.315 | 3 | ↓ |
| Mid Mid (pH 6-8) | 0.86 | 5.97 | -58.02 | 2 | 5 | 1 | 61 | 277.323 | 3 | ↓ |
