In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 12th, 2008 | 25 | No |
Popular Name: 5-(4-hydroxy-3-methoxybenzylidene)-1-phenyl-2,4,6(1H,3H,5H)-pyrimidinetrione 5-(4-hydroxy-3-methoxybenzyliden…
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) | 1.43 | 1.52 | -47.8 | 1 | 7 | -1 | 104 | 337.311 | 3 | ↓ |
Hi High (pH 8-9.5) | 1.43 | 2.44 | -102.83 | 0 | 7 | -2 | 107 | 336.303 | 3 | ↓ |
Hi High (pH 8-9.5) | 1.43 | 2.55 | -103.23 | 0 | 7 | -2 | 107 | 336.303 | 3 | ↓ |
Lo Low (pH 4.5-6) | 0.97 | 4.18 | -11.98 | 2 | 7 | 0 | 101 | 338.319 | 3 | ↓ |