Ligand
Ligand Name:   AEBSF
Ligand Type:   non-polymer
Ligand ID:   COVPDB487 PubChem:   1701
Synonym(s):  
  •   4-(2-aminoethyl)benzenesulfonyl fluoride
  • 34284-75-8
  • 4-(2-aminoethyl)benzenesulfonylfluoride
  • 4-(2-aminoethyl)benzene-1-sulfonyl fluoride
  • benzenesulfonyl fluoride, 4-(2-aminoethyl)-
  • aebsf.hcl
  • aes
  • 4-beta-aminoethylbenzolsulfofluoride
  • chembl1256178
  • 4-(2-aminoethyl)-benzenesulfonyl fluoride
  • sr-01000075690
  • lopac-a-8456
  • lopac0_000132
  • schembl77781
  • chembl1096339
  • dtxsid40187844
  • zinc8034834
  • bdbm50398077
  • 4-(2-aminoethyl)phenylsulfonylfluoride
  • ccg-204227
  • db07347
  • sdccgsbi-0050120.p002
  • ncgc00015097-01
  • ncgc00015097-02
  • ncgc00015097-03
  • ncgc00015097-12
  • ncgc00162071-01
  • [4-(2-aminoethyl)-benzenesulphonyl fluoride]
  • 186948-ep2270113a1
  • 186948-ep2272935a1
  • 186948-ep2374526a1
  • q290992
  • sr-01000075690-6
show 32 synonym(s)
DrugBank:   DB07347 ChEMBL:   CHEMBL1096339
Canonical SMILES:   NCCc1ccc(cc1)S(F)(=O)=O
Standard InChI:   InChI=1S/C8H10FNO2S/c9-13(11,12)8-3-1-7(2-4-8)5-6-10/h1-4H,5-6,10H2
Molecular Formula:   C8H10FNO2S Mol. Weight:   203.04163 logP:   0.846
HBD:   1 HBA:   3
#Rotatable Bonds:   3 TPSA:   60.16

Bound Proteins
Protein Name Uniprot ID/ACC Organism PDB ID HET Code Binding Affinity Binding Database Complex Card
pH 6 antigen P31522 (PSAA_YERPE) Yersinia pestis 4F8O AES
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SHOW
Streptogrisin C. Serine peptidase. MEROPS family S01A Q47SP5 (Q47SP5_THEFY) Thermobifida fusca (strain YX) 2PFE AES
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SHOW
Alpha-lytic protease P00778 (PRLA_LYSEN) Lysobacter enzymogenes 3PRO AES
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SHOW