Ligand
Ligand Name:   ETX1317
Ligand Type:   non-polymer
Ligand ID:   COVPDB1460 PubChem:   -
Synonym(s):   -
DrugBank:   - ChEMBL:   -
Canonical SMILES:   CC1=C[C@H](N2C[C@H]1N(O[C@H](F)C(O)=O)C2=O)C(N)=O
Standard InChI:   InChI=1S/C10H12FN3O5/c1-4-2-5(8(12)15)13-3-6(4)14(10(13)18)19-7(11)9(16)17/h2,5-7H,3H2,1H3,(H2,12,15)(H,16,17)/t5-,6+,7-/m0/s1
Molecular Formula:   C10H12FN3O5 Mol. Weight:   273.0761 logP:   -0.7818
HBD:   2 HBA:   4
#Rotatable Bonds:   4 TPSA:   113.17

Bound Proteins
Protein Name Uniprot ID/ACC Organism PDB ID HET Code Binding Affinity Binding Database Complex Card
Beta-lactamase Q9L5C7 (Q9L5C7_ECOLX) Escherichia coli 6VHS X57
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