| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 23rd, 2010 | 23 | Yes |
Popular Name: 3-[4-[[5-(3-fluorophenyl)-2-thienyl]methyl]piperazin-1-yl]propanenitrile 3-[4-[[5-(3-fluorophenyl)-2-thie…
None
| 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) | 3.05 | 9.96 | -48.74 | 1 | 3 | 1 | 31 | 330.452 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.05 | 9.98 | -52.93 | 1 | 3 | 1 | 31 | 330.452 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.05 | 7.71 | -8.98 | 0 | 3 | 0 | 30 | 329.444 | 5 | ↓ |
