| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 25th, 2010 | 21 | Yes |
Popular Name: 3-[4-[(2-fluorophenyl)methyl]piperazin-1-yl]-2,2-dimethyl-3-oxo-propanenitrile 3-[4-[(2-fluorophenyl)methyl]pip…
| 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) | 2.01 | 5.94 | -8.05 | 0 | 4 | 0 | 47 | 289.354 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 2.01 | 8.17 | -39.37 | 1 | 4 | 1 | 49 | 290.362 | 3 | ↓ |
