UCSF

ZINC39307125

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Substance Information

In ZINC since Heavy atoms Benign functionality
February 12th, 2010 13 No

Popular Name: 2-(3,4-Dimethoxyphenyl)ethanethiol 2-(3,4-Dimethoxyphenyl)ethanethiol

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CAS Number: 62978-83-0

Other Names:

MFCD11521157

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) 2.08 5.33 -6.11 0 2 0 18 198.287 4 ↓

Vendor Notes

Note Type Comments Provided By
Purity 97% Fluorochem

Activity (Go SEA)

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