UCSF

ZINC13999290

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 1st, 2008 17 Yes

Popular Name: 3-(4-Dimethylsulfamoyl-phenyl)-propionic acid 3-(4-Dimethylsulfamoyl-phenyl)-p…

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CAS Numbers: 91248-47-4 , [91248-47-4]

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) 1.19 3.72 -49.52 0 5 -1 78 256.303 5 ↓

Vendor Notes

Note Type Comments Provided By
Warnings IRRITANT Matrix Scientific

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