In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 12th, 2008 | 20 | Yes |
Popular Name: 2-(4-acetylphenyl)sulfanyl-6-propyl-1H-pyrimidin-4-one 2-(4-acetylphenyl)sulfanyl-6-pro…
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) | 3.32 | 7.31 | -12.89 | 1 | 4 | 0 | 63 | 288.372 | 5 | ↓ |
Hi High (pH 8-9.5) | 3.78 | 6.46 | -44.66 | 0 | 4 | -1 | 66 | 287.364 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.32 | 6.74 | -22.03 | 1 | 4 | 0 | 63 | 288.372 | 5 | ↓ |