In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 19th, 2008 | 9 | Yes |
Popular Name: 4-Bromo-2,6-dimethylpyridine 4-Bromo-2,6-dimethylpyridine
Find On: PubMed — Wikipedia — Google
CAS Numbers: 3978-81-2 , 5093-70-9 , 72587-18-9 , 93-70-9 , [5093-70-9]
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) | 2.34 | 4.56 | -3.29 | 0 | 1 | 0 | 13 | 186.052 | 0 | ↓ |
Lo Low (pH 4.5-6) | 2.34 | 4.81 | -27.75 | 1 | 1 | 1 | 14 | 187.06 | 0 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
MP | 32-34° | Matrix Scientific |
Purity | 95+% | Matrix Scientific |
Purity | 98% | Fluorochem |
Warnings | IRRITANT | Matrix Scientific |
No pre-computed analogs available. Try a structural similarity search.