| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 17th, 2010 | 8 | Yes |
Popular Name: 1,3-Dimethyl-piperazine 1,3-Dimethyl-piperazine
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CAS Numbers: 1022094-05-8 , 1033717-21-3 , 1152110-26-3 , 22317 , 22317-01-7 , 84477-85-0 , [22317-01-7]
(R)-1,3-Dimethylpiperazine dihydrochloride
1,3-Dimethyl-piperazine hydrochloride
1,3-Dimethylpiperazine hydrochloride
| 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) | 0.32 | 0.57 | -33.66 | 2 | 2 | 1 | 20 | 115.2 | 0 | ↓ |
| Hi High (pH 8-9.5) | 0.32 | -0.71 | -1.69 | 1 | 2 | 0 | 15 | 114.192 | 0 | ↓ |
| Lo Low (pH 4.5-6) | 0.32 | 2.98 | -103.52 | 3 | 2 | 2 | 21 | 116.208 | 0 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| Purity | 95% | Fluorochem |
No pre-computed analogs available. Try a structural similarity search.