In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
June 25th, 2008 | 26 | No |
Popular Name: 1-(2-fluorophenyl)-5-(4-hydroxy-3-methoxybenzylidene)-2,4,6(1H,3H,5H)-pyrimidinetrione 1-(2-fluorophenyl)-5-(4-hydroxy-…
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 | 1.9 | -49.68 | 1 | 7 | -1 | 104 | 355.301 | 3 | ↓ |
Ref Reference (pH 7) | 1.76 | 1.79 | -50.97 | 1 | 7 | -1 | 104 | 355.301 | 3 | ↓ |
Hi High (pH 8-9.5) | 1.76 | 2.83 | -114.25 | 0 | 7 | -2 | 107 | 354.293 | 3 | ↓ |
Hi High (pH 8-9.5) | 1.76 | 2.71 | -112.02 | 0 | 7 | -2 | 107 | 354.293 | 3 | ↓ |
Lo Low (pH 4.5-6) | 1.30 | 4.34 | -14 | 2 | 7 | 0 | 101 | 356.309 | 3 | ↓ |