In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 20th, 2009 | 15 | Yes |
Popular Name: 2-Amino-1-(2-ethyl-1-piperidinyl)-3-methyl-1-butanone hydrochloride 2-Amino-1-(2-ethyl-1-piperidinyl…
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CAS Numbers: 1236266-36-6 , N/A , [1236266-36-6]
2-amino-1-(2-ethyl-1-piperidinyl)-3-methyl-1-butanonehydrochloride
2-Amino-1-(2-ethylpiperidin-1-yl)-3-methylbutan-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) | 1.42 | 4.26 | -40.02 | 3 | 3 | 1 | 48 | 213.345 | 3 | ↓ |
Hi High (pH 8-9.5) | 1.42 | 4.01 | -6.23 | 2 | 3 | 0 | 46 | 212.337 | 3 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
Warnings | IRRITANT | Matrix Scientific |