| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 15th, 2013 | 0 | No |
Popular Name: 5-(3-Chlorophenyl)cyclohexane-1,3-dione 5-(3-Chlorophenyl)cyclohexane-1,…
Find On: PubMed — Wikipedia — Google
CAS Numbers: 55579-71-0 , [55579-71-0]
| 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 |
|---|---|---|---|---|---|---|---|---|---|---|
| Hi High (pH 8-9.5) | 3.65 | 6.51 | -8.13 | 2 | 4 | 0 | 58 | 354.425 | 6 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Purity | 97% | Fluorochem |
No pre-computed analogs available. Try a structural similarity search.