| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 25th, 2008 | 19 | Yes |
Popular Name: 5-(4-n-Butylphenyl)-3-methyl-5-oxovaleric acid 5-(4-n-Butylphenyl)-3-methyl-5-o…
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CAS Number: 845781-46-6
| 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) | 3.86 | 9.78 | -52.05 | 0 | 3 | -1 | 57 | 261.341 | 8 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Purity | 95% | Fluorochem |
