| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 16th, 2009 | 17 | Yes |
Popular Name: 4-(2-chlorophenyl)-2-(pyrrolidin-2-yl)-1H-imidazole hydrochloride 4-(2-chlorophenyl)-2-(pyrrolidin…
Find On: PubMed — Wikipedia — Google
CAS Numbers: 1155056-47-5 , 1315365-95-7
| 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) | 2.48 | 6.76 | -36.58 | 3 | 3 | 1 | 45 | 248.737 | 2 | ↓ |
| Hi High (pH 8-9.5) | 2.48 | 4.45 | -6.08 | 2 | 3 | 0 | 41 | 247.729 | 2 | ↓ |
| Hi High (pH 8-9.5) | 2.48 | 5.09 | -8.08 | 2 | 3 | 0 | 41 | 247.729 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 2.48 | 6.52 | -103.93 | 4 | 3 | 2 | 47 | 249.745 | 2 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| MP | 247 - 249 | Enamine Building Blocks |
| MP | 247...249 | Enamine Building Blocks |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
No pre-computed analogs available. Try a structural similarity search.
