| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 6th, 2011 | 22 | No |
Popular Name: (1E)-N-[4-(difluoromethylsulfanyl)phenyl]-4-(2-hydroxyethyl)piperazine-1-carboximidothioic (1E)-N-[4-(difluoromethylsulfany…
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) | -1.70 | 6.65 | -48.08 | 3 | 4 | 1 | 40 | 348.464 | 6 | ↓ |
| Hi High (pH 8-9.5) | 2.52 | 6.24 | -46.47 | 2 | 4 | 0 | 40 | 347.456 | 6 | ↓ |
| Mid Mid (pH 6-8) | -1.70 | 4.36 | -11.78 | 2 | 4 | 0 | 38 | 347.456 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
