UCSF

ZINC02455263

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 26th, 2004 18 Yes

Popular Name: 4-{[Butyl(methyl)amino]sulfonyl}benzoic acid 4-{[Butyl(methyl)amino]sulfonyl}…

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CAS Numbers: , 887202-44-0

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) 2.60 -2.84 -49.93 0 5 -1 77 270.33 6 ↓

Vendor Notes

Note Type Comments Provided By
Purity 95+% Fluorochem
Warnings IRRITANT Matrix Scientific

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