| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 19th, 2011 | 27 | Yes |
Popular Name: 4-[2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]ethoxy]benzonitrile 4-[2-[4-[3-(trifluoromethyl)phen…
| 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) | 4.24 | 9.23 | -8.79 | 0 | 4 | 0 | 40 | 375.394 | 6 | ↓ |
| Mid Mid (pH 6-8) | 4.24 | 11.49 | -52.57 | 1 | 4 | 1 | 41 | 376.402 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
