| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 21st, 2008 | 16 | Yes |
Popular Name: 5-(4-Bromo-phenyl)-3-methyl-isoxazole-4-carboxylic acid 5-(4-Bromo-phenyl)-3-methyl-isox…
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CAS Numbers: 91182-60-4 , [91182-60-4]
5-(4-bromo-phenyl)-3-methyl-isoxazole-4-carboxylicacid
5-(4-bromophenyl)-3-methyl-1,2-oxazole-4-carboxylic acid
5-(4-Bromophenyl)-3-methylisoxazole-4-carboxylic acid
5-(4-bromophenyl)-3-methylisoxazole-4-carboxylicacid
| 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) | 2.87 | 6.45 | -46.66 | 0 | 4 | -1 | 66 | 281.085 | 2 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Purity | 95% | Fluorochem |
| Purity | 95+% | Matrix Scientific |
| Warnings | IRRITANT | Matrix Scientific |
No pre-computed analogs available. Try a structural similarity search.