| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 21st, 2006 | 9 | Yes |
Popular Name: 1-(tert-Butyl)-1H-imidazole 1-(tert-Butyl)-1H-imidazole
Find On: PubMed — Wikipedia — Google
CAS Numbers: 45676-04-8 , [45676-04-8]
| 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) | 1.18 | 6 | -27.63 | 1 | 2 | 1 | 19 | 125.195 | 1 | ↓ |
| Hi High (pH 8-9.5) | 3.46 | 6.56 | -9.34 | 2 | 5 | 0 | 82 | 361.445 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.18 | 5.49 | -5.65 | 0 | 2 | 0 | 18 | 124.187 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Purity | 95% | Fluorochem |
No pre-computed analogs available. Try a structural similarity search.