| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 22nd, 2009 | 21 | Yes |
Popular Name: 2-[2-(2-fluorophenyl)sulfanylethyl-methyl-amino]-1-piperazin-1-yl-ethanone 2-[2-(2-fluorophenyl)sulfanyleth…
| 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) | 1.16 | 6.39 | -45.43 | 2 | 4 | 1 | 37 | 312.434 | 6 | ↓ |
| Hi High (pH 8-9.5) | 1.16 | 4.12 | -10.22 | 1 | 4 | 0 | 36 | 311.426 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.16 | 7.67 | -107.14 | 3 | 4 | 2 | 41 | 313.442 | 6 | ↓ |
