| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 31st, 2005 | 9 | No |
Popular Name: 4-bromo-5-nitro-1H-imidazole 4-bromo-5-nitro-1H-imidazole
Find On: PubMed — Wikipedia — Google
CAS Numbers: 6963-65-1 , [6963-65-1]
None
| 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) | 0.94 | 4.15 | -14.98 | 1 | 5 | 0 | 75 | 191.972 | 1 | ↓ |
| Hi High (pH 8-9.5) | 0.94 | 3.69 | -28.94 | 0 | 5 | -1 | 73 | 190.964 | 1 | ↓ |
| Mid Mid (pH 6-8) | 0.94 | 4.65 | -45.43 | 2 | 5 | 1 | 76 | 192.98 | 1 | ↓ |
| Mid Mid (pH 6-8) | 0.94 | 4.22 | -9.06 | 1 | 5 | 0 | 75 | 191.972 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
No pre-computed analogs available. Try a structural similarity search.