UCSF

ZINC00240845

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 15th, 2005 15 Yes

Popular Name: 4-Methoxy-1-naphthoic acid 4-Methoxy-1-naphthoic acid

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CAS Numbers: 13041-62-8 , [13041-62-8]

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) 2.68 0.97 -54.03 0 3 -1 49 201.201 2 ↓
Hi High (pH 8-9.5) 3.72 6.83 -7.87 0 4 0 40 312.078 4 ↓

Vendor Notes

Note Type Comments Provided By
MP 230° Matrix Scientific
Purity 95% Fluorochem
Warnings IRRITANT Matrix Scientific

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