| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 18th, 2011 | 28 | Yes |
Popular Name: N-[(4-fluorophenyl)methyl]-2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]acetamide N-[(4-fluorophenyl)methyl]-2-[4-…
| 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) | 3.97 | 7.88 | -10.22 | 1 | 4 | 0 | 36 | 395.4 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 3.97 | 10.02 | -48.57 | 2 | 4 | 1 | 37 | 396.408 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
