| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 7th, 2005 | 21 | Yes |
Popular Name: [1-(3,4-Dimethoxy-phenyl)-but-3-enyl]-furan-2-ylmethyl-amine [1-(3,4-Dimethoxy-phenyl)-but-3-…
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CAS Numbers: 340025-60-7 , 435342-09-9 , [435342-09-9]
DIMETHOXYPHENYLBUTENYLFURANYLMETHYLAMIN
DIMETHOXYPHENYLBUTENYLFURANYLMETHYLAMINEHYDROCHLORID
[1-(3,4-Dimethoxy-phenyl)-but-3-enyl]-furan-2-ylmethyl-amine hydrochloride
[1-(3,4-dimethoxy-phenyl)-but-3-enyl]-furan-2-ylmethyl-aminehydrochloride
| 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) | 2.00 | 7.47 | -43.09 | 2 | 4 | 1 | 48 | 288.367 | 8 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Warnings | IRRITANT | Matrix Scientific |
No pre-computed analogs available. Try a structural similarity search.