Ligand
Ligand Name:   [5-(aminomethyl)-1-benzothiophen-2-yl]boronic acid
Ligand Type:   non-polymer
Ligand ID:   COVPDB898 PubChem:   -
Synonym(s):   -
DrugBank:   - ChEMBL:   -
Canonical SMILES:   OB(O)c(s1)cc(c12)cc(cc2)C[NH3+]
Standard InChI:   InChI=1S/C9H10BNO2S/c11-5-6-1-2-8-7(3-6)4-9(14-8)10(12)13/h1-4,12-13H,5,11H2/p+1
Molecular Formula:   C9H11BNO2S+ Mol. Weight:   208.0598 logP:   -0.677
HBD:   3 HBA:   3
#Rotatable Bonds:   2 TPSA:   68.1

Bound Proteins
Protein Name Uniprot ID/ACC Organism PDB ID HET Code Binding Affinity Binding Database Complex Card
Beta-lactamase Q09HD0 (Q09HD0_KLEPN) Klebsiella pneumoniae 6Q35 HD5
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