| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 18th, 2008 | 14 | Yes |
Popular Name: Methyl 4-bromo-1H-indazole-6-carboxylate Methyl 4-bromo-1H-indazole-6-car…
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CAS Numbers: 885518-47-8 , [885518-47-8]
1H-Indazole-6-carboxylic acid, 4-bromo-, methyl ester
Methyl 4-bromo-6-(1H)-indazole carboxylate
methyl-4-broMo-6-(1H)-indazole carboxylate
| 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) | 2.51 | 4.37 | -5.46 | 1 | 4 | 0 | 55 | 255.071 | 2 | ↓ |
| Ref Reference (pH 7) | 2.51 | 4.42 | -8.68 | 1 | 4 | 0 | 55 | 255.071 | 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.