UCSF

ZINC08575917

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Substance Information

In ZINC since Heavy atoms Benign functionality
August 2nd, 2006 15 Yes

Popular Name: 3-(2-Methoxyphenyl)-3-methylbutanoic acid 3-(2-Methoxyphenyl)-3-methylbuta…

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CAS Number: 33214-38-9

Other Names:

MFCD00796475

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) 2.61 2.25 -48.09 0 3 -1 49 207.249 4 ↓

Vendor Notes

Note Type Comments Provided By
PUBCHEM_PATENT_ID WO2000001692A1 IBM Patent Data

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