| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 1st, 2008 | 12 | Yes |
Popular Name: 2-Amino-1-(1-azepanyl)-1-propanone hydrochloride 2-Amino-1-(1-azepanyl)-1-propano…
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CAS Numbers: 1236260-29-9 , N/A , [1236260-29-9]
2-amino-1-(1-azepanyl)-1-propanonehydrochloride
2-Amino-1-(azepan-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) | 0.28 | 2.5 | -43.57 | 3 | 3 | 1 | 48 | 171.264 | 1 | ↓ |
| Hi High (pH 8-9.5) | 0.28 | 2.17 | -5.72 | 2 | 3 | 0 | 46 | 170.256 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Warnings | IRRITANT | Matrix Scientific |
