UCSF

ZINC01529390

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 6th, 2004 13 Yes

Popular Name: 4-Sulfobenzoic acid, potassium salt 4-Sulfobenzoic acid, potassium salt

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CAS Numbers: 22959-32-6 , 5399-63-3 , 636-78-2 , [5399-63-3]

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) -1.16 -5.98 -92.89 0 5 -2 97 200.171 2 ↓

Vendor Notes

Note Type Comments Provided By
S phrase S24/25: Avoid contact with skin and eyes. Acros Organics
UniProt Database Links TSAC_COMTE ChEBI

Activity (Go SEA)

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