UCSF

ZINC02513610

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 27th, 2004 14 Yes

Popular Name: 3,5-Dimethoxy-4-hydroxyphenethylaminehydrochloride 3,5-Dimethoxy-4-hydroxyphenethyl…

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CAS Numbers: 2176-14-9 , 2413-00-5 , [2176-14-9]

Download: MOL2 SDF SMILES Flexibase

Physical Representations

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) 0.28 0.32 -55.06 4 4 1 66 198.242 4 ↓

Vendor Notes

Note Type Comments Provided By
MP 260-262° Matrix Scientific
Warnings IRRITANT Matrix Scientific

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Analogs ( Draw Identity 99% 90% 80% 70% )

No pre-computed analogs available. Try a structural similarity search.