| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 4th, 2010 | 20 | No |
Popular Name: 1-(3,4-dihydroxyphenyl)-2-[isopropyl(2,2,2-trifluoroethyl)amino]ethanone 1-(3,4-dihydroxyphenyl)-2-[isopr…
| 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) | 2.12 | 1.75 | -12.33 | 2 | 4 | 0 | 61 | 291.269 | 6 | ↓ |
| Hi High (pH 8-9.5) | 2.12 | 2.67 | -46.12 | 1 | 4 | -1 | 64 | 290.261 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 2.12 | 3.4 | -49.67 | 3 | 4 | 1 | 62 | 292.277 | 6 | ↓ |
