| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 26th, 2010 | 9 | Yes |
Popular Name: 4-Bromo-1,3-thiazole-2-carboxylic acid 4-Bromo-1,3-thiazole-2-carboxyli…
Find On: PubMed — Wikipedia — Google
CAS Numbers: 88982-82-5 , [88982-82-5]
2-Thiazolecarboxylic acid, 4-bromo-
4-Bromothiazole-2-carboxylic acid
| 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) | 1.11 | 2.63 | -43.39 | 0 | 3 | -1 | 53 | 207.028 | 1 | ↓ |
| Hi High (pH 8-9.5) | 4.24 | 9.93 | -11.8 | 1 | 6 | 0 | 74 | 408.498 | 9 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| Purity | 95% | Matrix Scientific |
| Purity | 96% | Fluorochem |
| Warnings | IRRITANT | Matrix Scientific |
No pre-computed analogs available. Try a structural similarity search.