| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 2nd, 2009 | 18 | Yes |
Popular Name: 1-(2,4-dihydroxyphenyl)-2-[(3R)-3-methyl-1-piperidyl]ethanone 1-(2,4-dihydroxyphenyl)-2-[(3R)-…
| 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) | 2.08 | 4.55 | -42.82 | 3 | 4 | 1 | 62 | 250.318 | 3 | ↓ |
| Hi High (pH 8-9.5) | 2.08 | 3.16 | -43.53 | 1 | 4 | -1 | 64 | 248.302 | 3 | ↓ |
| Hi High (pH 8-9.5) | 2.08 | 3.39 | -53.58 | 1 | 4 | -1 | 64 | 248.302 | 3 | ↓ |
| Hi High (pH 8-9.5) | 2.08 | 2.39 | -9.56 | 2 | 4 | 0 | 61 | 249.31 | 3 | ↓ |
| Mid Mid (pH 6-8) | 2.08 | 5.56 | -57 | 2 | 4 | 0 | 65 | 249.31 | 3 | ↓ |
