| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 1st, 2008 | 11 | Yes |
Popular Name: 2-Amino-1-(1-azepanyl)-1-ethanone hydrochloride 2-Amino-1-(1-azepanyl)-1-ethanon…
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CAS Numbers: 1220036-33-8 , N/A , [1220036-33-8]
2-amino-1-(1-azepanyl)-1-ethanonehydrochloride
2-Amino-1-(azepan-1-yl)ethanone 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) | -0.12 | 2.07 | -45.73 | 3 | 3 | 1 | 48 | 157.237 | 1 | ↓ |
| Hi High (pH 8-9.5) | -0.12 | 1.68 | -8.19 | 2 | 3 | 0 | 46 | 156.229 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Warnings | IRRITANT | Matrix Scientific |
