| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 4th, 2010 | 19 | No |
Popular Name: 1-(3,4-dihydroxyphenyl)-2-[ethyl-[(1S)-2-methoxy-1-methyl-ethyl]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) | 1.21 | 2.4 | -38.55 | 3 | 5 | 1 | 71 | 268.333 | 7 | ↓ |
| Hi High (pH 8-9.5) | 1.21 | 1.72 | -44.4 | 1 | 5 | -1 | 73 | 266.317 | 7 | ↓ |
| Mid Mid (pH 6-8) | 1.21 | 0.79 | -9.92 | 2 | 5 | 0 | 70 | 267.325 | 7 | ↓ |
