UCSF

ZINC06007868

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Substance Information

In ZINC since Heavy atoms Benign functionality
February 22nd, 2006 16 Yes

Popular Name: 2-[3-(trifluoromethyl)phenoxy]propanoic acid 2-[3-(trifluoromethyl)phenoxy]pr…

Find On: PubMed — Wikipedia — Google

CAS Numbers: 836-35-1 , [836-35-1]

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) 2.47 3.35 -46.42 0 3 -1 49 233.165 4 ↓

Vendor Notes

Note Type Comments Provided By
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95% Fluorochem
Warnings IRRITANT Matrix Scientific

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