In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 2nd, 2009 | 20 | Yes |
Popular Name: (2S)-2-(4-hydroxypyrimidin-2-yl)sulfanyl-1-(4-methoxyphenyl)propan-1-one (2S)-2-(4-hydroxypyrimidin-2-yl)…
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) | 2.50 | 5.64 | -12.38 | 1 | 5 | 0 | 72 | 290.344 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.96 | 3.9 | -44.7 | 0 | 5 | -1 | 75 | 289.336 | 5 | ↓ |