| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 24th, 2009 | 17 | No |
Popular Name: 1-(3,4-dihydroxyphenyl)-2-[ethyl(isopropyl)amino]ethanone 1-(3,4-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) | 1.57 | 3.07 | -41.74 | 3 | 4 | 1 | 62 | 238.307 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.57 | 2.1 | -44.73 | 1 | 4 | -1 | 64 | 236.291 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.57 | 1.18 | -10.63 | 2 | 4 | 0 | 61 | 237.299 | 5 | ↓ |
