In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 1st, 2009 | 17 | Yes |
Popular Name: 1-[2-(4-hydroxypyrimidin-2-yl)sulfanylphenyl]ethanone 1-[2-(4-hydroxypyrimidin-2-yl)su…
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) | 1.76 | 5.09 | -13.58 | 1 | 4 | 0 | 63 | 246.291 | 3 | ↓ |
Hi High (pH 8-9.5) | 2.22 | 3.12 | -53.69 | 0 | 4 | -1 | 66 | 245.283 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.76 | 4.44 | -22.04 | 1 | 4 | 0 | 63 | 246.291 | 3 | ↓ |