In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 6th, 2007 | 17 | Yes |
Popular Name: 2-(4-hydroxypyrimidin-2-yl)sulfanyl-1-phenyl-ethanone 2-(4-hydroxypyrimidin-2-yl)sulfa…
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) | 2.08 | 5.49 | -12.81 | 1 | 4 | 0 | 63 | 246.291 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.54 | 4.37 | -45.54 | 0 | 4 | -1 | 66 | 245.283 | 4 | ↓ |
Mid Mid (pH 6-8) | 2.08 | 4.88 | -19.47 | 1 | 4 | 0 | 63 | 246.291 | 4 | ↓ |