| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 13th, 2010 | 19 | No |
Popular Name: tert-Butyl 6-nitro-1H-indazole-1-carboxylate tert-Butyl 6-nitro-1H-indazole-1…
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CAS Numbers: 219503-74-9 , [219503-74-9]
1H-Indazole-1-carboxylic acid, 6-nitro-, 1,1-dimethylethyl ester
| 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) | 2.66 | 6.76 | -15.32 | 0 | 7 | 0 | 90 | 263.253 | 3 | ↓ |
| Hi High (pH 8-9.5) | 2.15 | 4.95 | -7.43 | 1 | 4 | 0 | 56 | 276.332 | 2 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Purity | 95% | Fluorochem |
No pre-computed analogs available. Try a structural similarity search.