Ligand
Ligand Name:   (3,5-di-tert-butylphenyl)boronic acid
Ligand Type:   non-polymer
Ligand ID:   COVPDB117 PubChem:   11470330
Synonym(s):  
  •   197223-39-5
  • 3,5-di-t-butylphenylboronic acid
  • (3,5-ditert-butylphenyl)boronic acid
  • 3,5-di-tert-butylphenylboronic acid
  • boronic acid, [3,5-bis(1,1-dimethylethyl)phenyl]-
  • mfcd07780212
  • boronic acid, b-[3,5-bis(1,1-dimethylethyl)phenyl]-
  • acmc-209f10
  • schembl1679450
  • amba00009
  • dtxsid80466928
  • 3,5-(tbu)2c6h3b(oh)2
  • 3,5-di-tert-butylphenylboranic acid
  • anw-23746
  • 3,5-di-tert-butylbenzeneboronic acid
  • akos015893130
  • zinc169746404
  • am80902
  • cs-w000895
  • ak-92797
  • as-20050
  • sy022731
  • ab0064518
  • z4363
  • b-7675
  • q27452730
show 25 synonym(s)
DrugBank:   - ChEMBL:   -
Canonical SMILES:   OB(O)c1cc(C(C)(C)C)cc(c1)C(C)(C)C
Standard InChI:   InChI=1S/C14H23BO2/c1-13(2,3)10-7-11(14(4,5)6)9-12(8-10)15(16)17/h7-9,16-17H,1-6H3
Molecular Formula:   C14H23BO2 Mol. Weight:   234.17911 logP:   1.9614
HBD:   2 HBA:   2
#Rotatable Bonds:   1 TPSA:   40.46

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) 4LV3 25N Ki : 3200 nM PDBBind SHOW