| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 2nd, 2008 | 18 | Yes |
Popular Name: 2-Amino-1-(4-benzyl-1-piperazinyl)-1-propanonehydrochloride 2-Amino-1-(4-benzyl-1-piperaziny…
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CAS Numbers: 1236265-35-2 , N/A , [1236265-35-2]
2-Amino-1-(4-benzyl-1-piperazinyl)-1-propanone hydrochloride
2-amino-1-(4-benzylpiperazin-1-yl)propan-1-one
2-Amino-1-(4-benzylpiperazin-1-yl)propan-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) | 0.16 | 2.8 | -46.67 | 3 | 4 | 1 | 51 | 248.35 | 3 | ↓ |
| Hi High (pH 8-9.5) | 0.16 | 2.48 | -10.02 | 2 | 4 | 0 | 50 | 247.342 | 3 | ↓ |
| Mid Mid (pH 6-8) | 0.16 | 5.06 | -106.24 | 4 | 4 | 2 | 52 | 249.358 | 3 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Warnings | IRRITANT | Matrix Scientific |
