| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 30th, 2009 | 24 | Yes |
Popular Name: 2-Amino-1-(4-benzyl-1-piperazinyl)-3-phenyl-1-propanone hydrochloride 2-Amino-1-(4-benzyl-1-piperaziny…
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CAS Numbers: 1236266-39-9 , N/A , [1236266-39-9]
2-amino-1-(4-benzyl-1-piperazinyl)-3-phenyl-1-propanonehydrochloride
2-Amino-1-(4-benzylpiperazin-1-yl)-3-phenylpropan-1-one 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) | 1.62 | 6.59 | -43.68 | 3 | 4 | 1 | 51 | 324.448 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.62 | 6.29 | -7.94 | 2 | 4 | 0 | 50 | 323.44 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 1.62 | 8.82 | -108.75 | 4 | 4 | 2 | 52 | 325.456 | 5 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Warnings | IRRITANT | Matrix Scientific |
