| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 26th, 2010 | 21 | Yes |
Popular Name: piperazin-1-yl-[(2S)-1-[2-(2,2,2-trifluoroethoxy)ethyl]pyrrolidin-2-yl]methanone piperazin-1-yl-[(2S)-1-[2-(2,2,2…
| 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) | 0.29 | 3.83 | -34.92 | 2 | 5 | 1 | 46 | 310.34 | 6 | ↓ |
| Mid Mid (pH 6-8) | 0.29 | 5.18 | -97.84 | 3 | 5 | 2 | 51 | 311.348 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
