| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 11th, 2011 | 17 | Yes |
Popular Name: (2S,5S)-1-[2-(4-fluorophenyl)ethyl]-2,5-dimethyl-piperazine (2S,5S)-1-[2-(4-fluorophenyl)eth…
| 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) | 2.62 | 5.65 | -38.59 | 2 | 2 | 1 | 20 | 237.342 | 3 | ↓ |
| Hi High (pH 8-9.5) | 2.62 | 4.54 | -2.78 | 1 | 2 | 0 | 15 | 236.334 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
