UCSF

ZINC05186961

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Substance Information

In ZINC since Heavy atoms Benign functionality
January 25th, 2006 16 Yes

Popular Name: 2-(4-Carbamoylphenoxy)-2-methylpropanoic acid 2-(4-Carbamoylphenoxy)-2-methylp…

Find On: PubMed — Wikipedia — Google

CAS Numbers: 121809-54-9 , [121809-54-9]

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) 0.87 2.09 -46.23 2 5 -1 92 222.22 4 ↓

Vendor Notes

Note Type Comments Provided By
PUBCHEM_PATENT_ID WO2000001692A1 IBM Patent Data

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