| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 20th, 2008 | 14 | No |
Popular Name: 1-(2,4-Difluorophenyl)butane-1,3-dione 1-(2,4-Difluorophenyl)butane-1,3…
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CAS Number: 64287-17-8
| 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) | 2.28 | 5.77 | -35.37 | 0 | 2 | -1 | 40 | 197.16 | 2 | ↓ |
| Mid Mid (pH 6-8) | 1.53 | 5.84 | -10.37 | 0 | 2 | 0 | 34 | 198.168 | 3 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| PUBCHEM_PATENT_ID | US5117057; US6013836 | IBM Patent Data |
