Ligand |
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Ligand Name: m-carboxyphenyl [[N-[(p-iodophenyl)acetyl]amino]methyl]phosphonate | ||
Ligand Type: non-polymer | ||
Ligand ID: COVPDB957 | PubChem: - | |
Synonym(s): - | ||
DrugBank: - | ChEMBL: - | |
Canonical SMILES: OC(=O)c1ccc(cc1)P(O)(=O)CNC(=O)Cc1ccc(I)cc1 | ||
Standard InChI: InChI=1S/C16H15INO5P/c17-13-5-1-11(2-6-13)9-15(19)18-10-24(22,23)14-7-3-12(4-8-14)16(20)21/h1-8H,9-10H2,(H,18,19)(H,20,21)(H,22,23) | ||
Molecular Formula: C16H15INO5P | Mol. Weight: 458.97327 | logP: 2.2015 |
HBD: 3 | HBA: 3 | |
#Rotatable Bonds: 6 | TPSA: 103.7 |
Bound Proteins |
Protein Name | Uniprot ID/ACC | Organism | PDB ID | HET Code | Binding Affinity | Binding Database | Complex Card |
Beta-lactamase | P05364 (AMPC_ENTCL) | Enterobacter cloacae | 1BLS | IPP |
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