| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 11th, 2008 | 11 | Yes |
Popular Name: 2-Bromopyridine-4-acetic acid 2-Bromopyridine-4-acetic acid
Find On: PubMed — Wikipedia — Google
CAS Numbers: 183483-29-6 , [183483-29-6]
2-(2-Bromopyridin-4-yl)acetic acid
2-bromo-4-pyridine acetic 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) | 1.22 | 3.65 | -43.53 | 0 | 3 | -1 | 53 | 215.026 | 2 | ↓ |
| Hi High (pH 8-9.5) | 2.85 | 5.6 | -11.19 | 2 | 6 | 0 | 91 | 377.444 | 7 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| PUBCHEM_PATENT_ID | EP0815100A1; US5696121; US5714609; US5719148; US5807853; WO1996030363A1 | IBM Patent Data |
No pre-computed analogs available. Try a structural similarity search.