| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 18th, 2009 | 24 | Yes |
Popular Name: 1-methyl-4-[[5-[3-(trifluoromethyl)phenyl]-3-pyridyl]methyl]piperazine 1-methyl-4-[[5-[3-(trifluorometh…
| 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) | 3.21 | 8.37 | -40.19 | 1 | 3 | 1 | 21 | 336.381 | 4 | ↓ |
| Mid Mid (pH 6-8) | 3.21 | 8.25 | -45.83 | 1 | 3 | 1 | 21 | 336.381 | 4 | ↓ |
| Mid Mid (pH 6-8) | 3.21 | 6 | -6.22 | 0 | 3 | 0 | 19 | 335.373 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 3.21 | 8.84 | -92.05 | 2 | 3 | 2 | 22 | 337.389 | 4 | ↓ |
