| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 11th, 2008 | 15 | Yes |
Popular Name: (2S,5S)-1-benzyl-2,5-dimethylpiperazine dihydrochloride (2S,5S)-1-benzyl-2,5-dimethylpip…
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CAS Numbers: 198896-00-3 , 260254-80-6 , 29906-55-6 , 324750-43-8 , 745031-35-0 , 956468-00-1
(2r,5r)-1-benzyl-2,5-dimethylpiperazinedihydrochloride
(2r,5s)-1-benzyl-2,5-dimethylpiperazinedihydrochloride
(2s,5r)-1-benzyl-2,5-dimethylpiperazinedihydrochloride
(2s,5s)-1-benzyl-2,5-dimethylpiperazinedihydrochloride
| 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) | 2.05 | 4.95 | -39.06 | 2 | 2 | 1 | 20 | 205.325 | 2 | ↓ |
| Hi High (pH 8-9.5) | 2.05 | 3.6 | -1.83 | 1 | 2 | 0 | 15 | 204.317 | 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.