Ligand
Ligand Name:   4-CARBOXYPHENYLboronic acid
Ligand Type:   non-polymer
Ligand ID:   COVPDB223 PubChem:   312183
Synonym(s):  
  •   14047-29-1
  • 4-boronobenzoic acid
  • benzoic acid, 4-borono-
  • 4-carboxybenzeneboronic acid
  • 4-(dihydroxyboranyl)benzoic acid
  • 4-(dihydroxyboryl)benzoic acid
  • p-carboxyphenylboronic acid
  • mfcd00151801
  • 4-carboxyphenylboronicacid
  • 4-phenylester boronic acid
  • 4-carboxyphenyl boronic acid
  • (4-carboxyphenyl)boronic acid
  • chembl82324
  • aurora 14935
  • p-carboxyphenyl boronic acid
  • 4-carboxyphenylboronic acid, 97%
  • benzoic acid, p-borono-
  • zlchem 424
  • p-borono benzoic acid
  • pubchem1772
  • acmc-1cbvs
  • wln: vhor dbqq
  • 4-carboxyphenyboronic acid
  • 4-carboxy-phenylboronic acid
  • 4-carboxy-benzeneboronic acid
  • 4-carboxybenzene boronic acid
  • 4-carboxybenzene-boronic acid
  • 4-carboxy phenyl boronic acid
  • 4-carboxy-phenyl boronic acid
  • schembl128618
  • ambz0266
  • 4-(dihydroxyboryl) benzoic acid
  • dtxsid20930850
  • zlc0280
  • hms3604i11
  • 4-(dihydroxyboramethyl)benzoic acid
  • 4-carboxylphenylboronic acid
  • acn-s003890
  • albb-006102
  • bcp03528
  • 4-carboxyphenylboronic acid (contains varying amounts of anhydride)
  • 4-hydroxycarbonyl-phenyl boronic acid
  • ac-981
  • anw-20566
  • bdbm50067885
  • ebd435385
  • nsc221170
  • sbb003899
  • stk499958
  • 4-dihydroxyboranyl-benzoic acid anion
  • akos000264728
  • zinc169743194
  • ab03988
  • as-2261
  • cs-w019665
  • db03140
  • ls10877
  • mcule-9853890632
  • nsc-221170
  • qc-4248
  • ncgc00092012-01
  • ncgc00092012-02
  • ak-45039
  • bc000139
  • sy001195
  • ab0010284
  • db-025037
  • am20020472
  • bb 0323402
  • ft-0600906
  • st50198242
  • en300-29555
  • b-2204
  • 38132-ep2308832a1
  • 38132-ep2311796a1
  • 38132-ep2311797a1
  • 38132-ep2311798a1
  • 38132-ep2311799a1
  • 047c291
  • af-399/25108028
  • q-102227
  • q27094084
  • f1371-0202
  • z1741960584
show 83 synonym(s)
DrugBank:   DB03140 ChEMBL:   CHEMBL82324
Canonical SMILES:   OB(O)c1ccc(cc1)C(O)=O
Standard InChI:   InChI=1S/C7H7BO4/c9-7(10)5-1-3-6(4-2-5)8(11)12/h1-4,11-12H,(H,9,10)
Molecular Formula:   C7H7BO4 Mol. Weight:   166.04373 logP:   -0.9354
HBD:   3 HBA:   3
#Rotatable Bonds:   2 TPSA:   77.76

Bound Proteins
Protein Name Uniprot ID/ACC Organism PDB ID HET Code Binding Affinity Binding Database Complex Card
Beta-lactamase P00811 (AMPC_ECOLI) Escherichia coli (strain K12) 1KDW 4CB Ki : 2900 nM PDBBind SHOW
Beta-lactamase P00811 (AMPC_ECOLI) Escherichia coli (strain K12) 1KDW 4CB Ki : 2900 nM BindingDB SHOW