| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 24th, 2004 | 14 | No |
Popular Name: Zingerone Zingerone
Find On: PubMed — Wikipedia — Google
CAS Numbers: 122-48-5 , [122-48-5]
122-48-5; C17497; Vanillylacetone; Zingerone; Zingiberone; [0]-Paradol
4-(4-Hydroxy-3-methoxyphenyl)-2-butanone
4-(4-Hydroxy-3-methoxyphenyl)-2-butanone, 97%
| 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) | 1.52 | 3.7 | -8.68 | 1 | 3 | 0 | 47 | 194.23 | 4 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| BP | 148 / 0.5 | TCI |
| Melting_Point | 39-42 | Alfa-Aesar |
| MP | 41 | TCI |
| Target | C-C motif chemokine 2(P13500)&Subtilisin-like serine protease pepC(P33295) | Herbal Ingredients Targets |
| Target | Others | Selleck Chemicals |
