UCSF

ZINC05958035

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Substance Information

In ZINC since Heavy atoms Benign functionality
February 20th, 2006 16 Yes

Popular Name: 1-(3,4-Dimethoxyphenyl)-2-(dimethylamino)ethanol 1-(3,4-Dimethoxyphenyl)-2-(dimet…

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CAS Number: 2970-95-8

Other Names:

MFCD11613279

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) 0.80 0.24 -42.23 2 4 1 43 226.296 5 ↓

Vendor Notes

Note Type Comments Provided By
PUBCHEM_PATENT_ID US4617409 IBM Patent Data

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