| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 1st, 2005 | 20 | Yes |
Popular Name: 2-(3,4-dimethoxyphenyl)-N-(pyridin-3-ylmethyl)ethanamine 2-(3,4-dimethoxyphenyl)-N-(pyrid…
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CAS Numbers: 1185294-49-8 , 1609395-55-2 , 356093-05-5 , [1185294-49-8]
DIMETHOXYPHENYLETHYLPYRIDINYLMETHYLAMINEHYDROCHLORID
[2-(3,4-Dimethoxy-phenyl)-ethyl]-pyridin-3-yl-methyl-amine hydrochloride
[2-(3,4-Dimethoxy-phenyl)-ethyl]-pyridin-3-ylmethyl-amine
[2-(3,4-dimethoxyphenyl)ethyl](3-pyridinylmethyl)amine dihydrobromide
| 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) | 1.71 | -0.13 | -54.29 | 2 | 4 | 1 | 47 | 273.356 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 1.71 | -0.02 | -116.72 | 3 | 4 | 2 | 49 | 274.364 | 7 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Warnings | IRRITANT | Matrix Scientific |
No pre-computed analogs available. Try a structural similarity search.