In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 26th, 2009 | 22 | Yes |
Popular Name: 1-(2,4-dihydroxyphenyl)-3-(3,4-dimethoxyphenyl)propan-1-one 1-(2,4-dihydroxyphenyl)-3-(3,4-d…
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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) | 2.87 | 4.45 | -18.43 | 2 | 5 | 0 | 76 | 302.326 | 6 | ↓ |
Hi High (pH 8-9.5) | 2.87 | 5.48 | -55.79 | 1 | 5 | -1 | 79 | 301.318 | 6 | ↓ |