In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 9th, 2009 | 16 | Yes |
Popular Name: 1-BENZYL-N,4-DIMETHYLPIPERIDIN-3-AMINE 1-BENZYL-N,4-DIMETHYLPIPERIDIN-3…
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CAS Numbers: 1062580-52-2 , 1228879-37-5 , 384338-23-2 , 477600-68-3 , 477600-69-4 , 477600-70-7
(3R,4R)-1-Benzyl-N,4-dimethylpiperidin-3-amine
(3R,4R)-1-Benzyl-N,4-dimethylpiperidin-3-aminedihydrochloride
(3S,4S)-1-Benzyl-N,4-dimethylpiperidin-3-amine
3-Piperidinamine, N,4-dimethyl-1-(phenylmethyl)-, hydrochloride (1:2)
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) | 2.39 | 6.56 | -32.39 | 2 | 2 | 1 | 16 | 219.352 | 3 | ↓ |
Lo Low (pH 4.5-6) | 2.39 | 7.81 | -110.07 | 3 | 2 | 2 | 21 | 220.36 | 3 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
Purity | 95% | Fluorochem |