| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 16th, 2009 | 18 | Yes |
Popular Name: 2-[4-(4-methylphenyl)-1H-imidazol-2-yl]piperidine dihydrochloride 2-[4-(4-methylphenyl)-1H-imidazo…
Find On: PubMed — Wikipedia — Google
CAS Numbers: 1153268-59-7 , 1354952-32-1
| 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) | 2.80 | 7.14 | -37.41 | 3 | 3 | 1 | 45 | 242.346 | 2 | ↓ |
| Hi High (pH 8-9.5) | 2.80 | 5.68 | -5.37 | 2 | 3 | 0 | 41 | 241.338 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 2.80 | 7.56 | -108.58 | 4 | 3 | 2 | 47 | 243.354 | 2 | ↓ |
| 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.
