Ligand
Ligand Name:   tosyl fluoride
Ligand Type:   non-polymer
Ligand ID:   COVPDB1399 PubChem:   9965
Synonym(s):  
  •   p-toluenesulfonyl fluoride
  • 455-16-3
  • 4-methylbenzenesulfonyl fluoride
  • 4-toluenesulfonyl fluoride
  • benzenesulfonyl fluoride, 4-methyl-
  • 4-tolylsulfonyl fluoride
  • p-toluenesulphonyl fluoride
  • toluene-4-sulfonyl fluoride
  • p-toluenesulfonylfluoride
  • p-methylbenzenesulfonyl fluoride
  • toluene-p-sulphonyl fluoride
  • p-methylphenylsulfonyl fluoride
  • nsc 2749
  • 4-methylbenzene-1-sulfonyl fluoride
  • fluoro(4-methylphenyl)sulfone
  • alpha-tolylsulfonyl fluoride
  • para-toluenesulfonyl fluoride
  • phenylmethane sulfonyl fluoride
  • einecs 207-238-6
  • brn 2208423
  • acmc-209k2x
  • wln: wsfr d1
  • schembl81712
  • 4-11-00-00375 (beilstein handbook reference)
  • dtxsid0060014
  • izzyabadqvqhlc-uhfffaoysa-
  • 4-methyl-benzenesulfonyl fluoride
  • nsc2749
  • p-toluenesulfonyl fluoride, 98%
  • nsc-2749
  • anw-30295
  • mfcd00007421
  • sbb088899
  • zinc85532952
  • akos015840472
  • mcule-3055425047
  • vs-0060
  • (4-methylphenyl)sulfonyl fluoride
  • ft-0619533
  • st51037904
  • v6030
  • k-9033
  • j-640211
  • j-800213
  • z1741957148
show 44 synonym(s)
DrugBank:   - ChEMBL:   -
Canonical SMILES:   Cc1ccc(S(F)(=O)=O)cc1
Standard InChI:   InChI=1S/C7H7FO2S/c1-6-2-4-7(5-3-6)11(8,9)10/h2-5H,1H3
Molecular Formula:   C7H7FO2S Mol. Weight:   174.01508 logP:   1.65322
HBD:   0 HBA:   2
#Rotatable Bonds:   1 TPSA:   34.14

Bound Proteins
Protein Name Uniprot ID/ACC Organism PDB ID HET Code Binding Affinity Binding Database Complex Card
Chymotrypsin-like elastase family member 1 P00772 (CELA1_PIG) Sus scrofa (Pig) 1EST TSU
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