In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 11th, 2010 | 20 | No |
Popular Name: 2-(4-methoxyphenyl)-1-(2,4,5-trihydroxyphenyl)ethanone 2-(4-methoxyphenyl)-1-(2,4,5-tri…
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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) | 2.27 | 1.69 | -13.84 | 3 | 5 | 0 | 87 | 274.272 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.27 | 2.68 | -53.38 | 2 | 5 | -1 | 90 | 273.264 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.27 | 2.63 | -46.42 | 2 | 5 | -1 | 90 | 273.264 | 4 | ↓ |