| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 18th, 2009 | 22 | Yes |
Popular Name: 1-[[5-(4-fluoro-3-methyl-phenyl)-3-pyridyl]methyl]-4-methyl-piperazine 1-[[5-(4-fluoro-3-methyl-phenyl)…
| 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) | 2.88 | 8.13 | -40.09 | 1 | 3 | 1 | 21 | 300.401 | 3 | ↓ |
| Mid Mid (pH 6-8) | 2.88 | 8.02 | -43.73 | 1 | 3 | 1 | 21 | 300.401 | 3 | ↓ |
| Mid Mid (pH 6-8) | 2.88 | 5.77 | -5.53 | 0 | 3 | 0 | 19 | 299.393 | 3 | ↓ |
