In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 7th, 2010 | 21 | No |
Popular Name: 1-(3,4-dihydroxyphenyl)-2-(3,4-dimethoxyphenyl)ethanone 1-(3,4-dihydroxyphenyl)-2-(3,4-d…
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) | 1.94 | 3.05 | -17.32 | 2 | 5 | 0 | 76 | 288.299 | 5 | ↓ |
Hi High (pH 8-9.5) | 1.94 | 3.97 | -48.89 | 1 | 5 | -1 | 79 | 287.291 | 5 | ↓ |