In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 6th, 2009 | 20 | No |
Popular Name: 2-(4-methoxyphenyl)-1-(2,3,4-trihydroxyphenyl)ethanone 2-(4-methoxyphenyl)-1-(2,3,4-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) | 2.29 | 2.83 | -19.03 | 3 | 5 | 0 | 87 | 274.272 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.29 | 4.25 | -127.13 | 1 | 5 | -2 | 93 | 272.256 | 4 | ↓ |
Mid Mid (pH 6-8) | 2.29 | 3.44 | -50.7 | 2 | 5 | -1 | 90 | 273.264 | 4 | ↓ |