| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 10th, 2008 | 14 | Yes |
Popular Name: 5-Bromoquinoline-2-carboxylic acid 5-Bromoquinoline-2-carboxylic acid
Find On: PubMed — Wikipedia — Google
CAS Numbers: 1017412-53-1 , [1017412-53-1]
| 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) | 2.65 | -1 | -52.58 | 0 | 3 | -1 | 53 | 251.059 | 1 | ↓ |
| Hi High (pH 8-9.5) | 0.81 | 3.99 | -92.42 | 7 | 8 | 2 | 126 | 409.469 | 4 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Purity | 95% | Fluorochem |
| Purity | 95+% | Matrix Scientific |
| Warnings | IRRITANT | Matrix Scientific |
No pre-computed analogs available. Try a structural similarity search.
