In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 13th, 2010 | 17 | Yes |
Popular Name: 2-(4-hydroxypyrimidin-2-yl)sulfanyl-1-piperazin-1-yl-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) | 0.04 | -0.23 | -71.59 | 2 | 6 | 0 | 86 | 254.315 | 3 | ↓ |
Hi High (pH 8-9.5) | 0.04 | -1.52 | -44.21 | 1 | 6 | -1 | 81 | 253.307 | 3 | ↓ |
Mid Mid (pH 6-8) | -0.42 | 1.77 | -58.46 | 3 | 6 | 1 | 83 | 255.323 | 3 | ↓ |