| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 22nd, 2009 | 16 | Yes |
Popular Name: Ethyl 2-(1H-imidazol-1-yl)benzoate Ethyl 2-(1H-imidazol-1-yl)benzoate
Find On: PubMed — Wikipedia — Google
CAS Numbers: 117296-92-1 , [117296-92-1]
| 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) | 1.64 | 8.22 | -11 | 0 | 4 | 0 | 44 | 216.24 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 1.64 | 9.25 | -29.73 | 1 | 4 | 1 | 45 | 217.248 | 4 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Purity | 95% | Fluorochem |
No pre-computed analogs available. Try a structural similarity search.