| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 2nd, 2009 | 20 | No |
Popular Name: 1-(3,4-dihydroxyphenyl)-2-(2,4-dimethylphenyl)sulfanyl-ethanone 1-(3,4-dihydroxyphenyl)-2-(2,4-d…
| 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) | 3.38 | 5.6 | -13.24 | 2 | 3 | 0 | 58 | 288.368 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.38 | 6.53 | -44.74 | 1 | 3 | -1 | 60 | 287.36 | 4 | ↓ |
