UCSF

ZINC21950713

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Substance Information

In ZINC since Heavy atoms Benign functionality
December 11th, 2008 16 Yes

Popular Name: 3-Fluoro-[1,1'-biphenyl]-4-carboxylic acid 3-Fluoro-[1,1'-biphenyl]-4-carbo…

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CAS Numbers: 137045-30-8 , 505082-76-8 , [505082-76-8]

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) 3.40 7.54 -52.93 0 2 -1 40 215.203 2 ↓

Vendor Notes

Note Type Comments Provided By
MP 187 - 189 Enamine Building Blocks
MP 187...189 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95% Fluorochem
PUBCHEM_PATENT_ID EP0357702B1 IBM Patent Data

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