In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 4th, 2010 | 19 | Yes |
Popular Name: 1-(2,4-dihydroxyphenyl)-2-[ethyl(2,2,2-trifluoroethyl)amino]ethanone 1-(2,4-dihydroxyphenyl)-2-[ethyl…
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) | 2.23 | 1.98 | -11.63 | 2 | 4 | 0 | 61 | 277.242 | 6 | ↓ |
Hi High (pH 8-9.5) | 2.23 | 2.99 | -54.81 | 1 | 4 | -1 | 64 | 276.234 | 6 | ↓ |
Lo Low (pH 4.5-6) | 2.23 | 3.5 | -48.96 | 3 | 4 | 1 | 62 | 278.25 | 6 | ↓ |