| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 18th, 2008 | 18 | Yes |
Popular Name: 4-[(3-Bromobenzyl)oxy]benzoic acid 4-[(3-Bromobenzyl)oxy]benzoic acid
Find On: PubMed — Wikipedia — Google
CAS Numbers: 860597-31-5 , [860597-31-5]
| 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) | 4.29 | 8.03 | -49.98 | 0 | 3 | -1 | 49 | 306.135 | 4 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Warnings | IRRITANT | Matrix Scientific |
No pre-computed analogs available. Try a structural similarity search.
