| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 22nd, 2008 | 13 | Yes |
Popular Name: 1-(1-Methyl-1H-imidazol-2-ylmethyl)-piperazine 1-(1-Methyl-1H-imidazol-2-ylmeth…
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CAS Number: 880361-71-7
1-((1-Methyl-1H-imidazol-2-yl)methyl)piperazine
| 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) | -0.80 | 2.26 | -85.44 | 3 | 4 | 2 | 39 | 182.271 | 2 | ↓ |
| Hi High (pH 8-9.5) | -0.80 | 0.93 | -28.06 | 2 | 4 | 1 | 34 | 181.263 | 2 | ↓ |
| Hi High (pH 8-9.5) | -0.80 | 2.07 | -41.88 | 2 | 4 | 1 | 38 | 181.263 | 2 | ↓ |
| Hi High (pH 8-9.5) | -0.80 | 0.71 | -7.09 | 1 | 4 | 0 | 33 | 180.255 | 2 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| Purity | 95% | Fluorochem |
