UCSF

ZINC02875549

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 4th, 2004 16 Yes

Popular Name: 4-Butoxy-3-methoxybenzoic acid 4-Butoxy-3-methoxybenzoic acid

Find On: PubMed — Wikipedia — Google

CAS Numbers: 3535-34-0 , [3535-34-0]

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) 2.93 1.35 -48.92 0 4 -1 58 223.248 6 ↓

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% )