In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 18th, 2008 | 11 | Yes |
Popular Name: 3-bromoisoquinoline 3-bromoisoquinoline
Find On: PubMed — Wikipedia — Google
CAS Numbers: 34784-02-6 , [34784-02-6]
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) | 3.20 | 5.49 | -5.78 | 0 | 1 | 0 | 13 | 208.058 | 0 | ↓ |
Lo Low (pH 4.5-6) | 3.20 | 5.77 | -29.14 | 1 | 1 | 1 | 14 | 209.066 | 0 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
Purity | 95% | Fluorochem |
Purity | 97% | Matrix Scientific |
Warnings | IRRITANT | Matrix Scientific |