| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 16th, 2009 | 18 | Yes |
Popular Name: 4-(3-methoxyphenyl)-2-(pyrrolidin-2-yl)-1H-imidazole dihydrochloride 4-(3-methoxyphenyl)-2-(pyrrolidi…
Find On: PubMed — Wikipedia — Google
CAS Numbers: 1153104-36-9 , 1384430-80-1
| 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) | 1.88 | 5.09 | -39.48 | 3 | 4 | 1 | 55 | 244.318 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.88 | 3.89 | -10.11 | 2 | 4 | 0 | 50 | 243.31 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.88 | 3.85 | -7.24 | 2 | 4 | 0 | 50 | 243.31 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 1.88 | 5.47 | -108.62 | 4 | 4 | 2 | 56 | 245.326 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 1.88 | 5.45 | -108.58 | 4 | 4 | 2 | 56 | 245.326 | 3 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| MP | 215 - 217 | Enamine Building Blocks |
| MP | 215...217 | Enamine Building Blocks |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
No pre-computed analogs available. Try a structural similarity search.
