| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 18th, 2008 | 20 | Yes |
Popular Name: 1-(2,4-dihydroxyphenyl)-2-(4,6-dihydroxypyrimidin-2-yl)sulfanyl-ethanone 1-(2,4-dihydroxyphenyl)-2-(4,6-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) | 1.64 | -2.32 | -61.03 | 3 | 7 | -1 | 126 | 293.28 | 4 | ↓ |
| Hi High (pH 8-9.5) | 1.64 | -0.5 | -179.5 | 1 | 7 | -3 | 132 | 291.264 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.64 | -1.29 | -102.28 | 2 | 7 | -2 | 129 | 292.272 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 1.64 | -1.21 | -39.14 | 4 | 7 | 0 | 128 | 294.288 | 4 | ↓ |
