UCSF

ZINC02567512

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 27th, 2004 17 Yes

Popular Name: Biphenyl-3-carboxylic acid ethyl ester Biphenyl-3-carboxylic acid ethyl…

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CAS Numbers: 19926-50-2 , 6301-56-0

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) 4.25 2.84 -7.39 0 2 0 26 226.275 4 ↓

Vendor Notes

Note Type Comments Provided By
BP 120°/0.14mm Oakwood Chemical

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