| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 16th, 2006 | 20 | Yes |
Popular Name: 1-(3,4-dimethylphenyl)-2-(4-hydroxy-6-methyl-pyrimidin-2-yl)sulfanyl-ethanone 1-(3,4-dimethylphenyl)-2-(4-hydr…
| 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) | 3.35 | 7.28 | -12.39 | 1 | 4 | 0 | 63 | 288.372 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.80 | 5.3 | -46.66 | 0 | 4 | -1 | 66 | 287.364 | 4 | ↓ |
| Mid Mid (pH 6-8) | 3.35 | 6.69 | -18.01 | 1 | 4 | 0 | 63 | 288.372 | 4 | ↓ |
