In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 13th, 2008 | 22 | Yes |
Popular Name: 1-(4-ethylphenyl)-2-(4-hydroxy-6-propyl-pyrimidin-2-yl)sulfanyl-ethanone 1-(4-ethylphenyl)-2-(4-hydroxy-6…
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) | 4.51 | 9.01 | -11.87 | 1 | 4 | 0 | 63 | 316.426 | 7 | ↓ |
Hi High (pH 8-9.5) | 4.97 | 7.89 | -47.35 | 0 | 4 | -1 | 66 | 315.418 | 7 | ↓ |