| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 2nd, 2008 | 12 | Yes |
Popular Name: 2-Amino-1-(4-methyl-1-piperazinyl)-1-propanonehydrochloride 2-Amino-1-(4-methyl-1-piperaziny…
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CAS Numbers: 1236254-86-6 , N/A , [1236254-86-6]
2-Amino-1-(4-methyl-1-piperazinyl)-1-propanone hydrochloride
2-Amino-1-(4-methylpiperazin-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) | -1.24 | -0.91 | -44.58 | 3 | 4 | 1 | 51 | 172.252 | 1 | ↓ |
| Hi High (pH 8-9.5) | -1.24 | -1.25 | -8.9 | 2 | 4 | 0 | 50 | 171.244 | 1 | ↓ |
| Mid Mid (pH 6-8) | -1.24 | 1.48 | -98.58 | 4 | 4 | 2 | 52 | 173.26 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Warnings | IRRITANT | Matrix Scientific |
