In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 19th, 2007 | 18 | Yes |
Popular Name: 1-(4-fluorophenyl)-2-(4-hydroxypyrimidin-2-yl)sulfanyl-ethanone 1-(4-fluorophenyl)-2-(4-hydroxyp…
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) | 2.25 | 5.53 | -12.98 | 1 | 4 | 0 | 63 | 264.281 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.70 | 3.54 | -42.38 | 0 | 4 | -1 | 66 | 263.273 | 4 | ↓ |
Mid Mid (pH 6-8) | 2.25 | 4.96 | -19.3 | 1 | 4 | 0 | 63 | 264.281 | 4 | ↓ |