Ligand
Ligand Name:   S17083
Ligand Type:   non-polymer
Ligand ID:   COVPDB1230 PubChem:   -
Synonym(s):   -
DrugBank:   - ChEMBL:   -
Canonical SMILES:   NC(=O)c1cccc(c1)-c1cn(CB(O)OP(O)(O)=O)nn1
Standard InChI:   InChI=1S/C10H12BN4O6P/c12-10(16)8-3-1-2-7(4-8)9-5-15(14-13-9)6-11(17)21-22(18,19)20/h1-5,17H,6H2,(H2,12,16)(H2,18,19,20)
Molecular Formula:   C10H12BN4O6P Mol. Weight:   326.05875 logP:   -0.827
HBD:   4 HBA:   7
#Rotatable Bonds:   6 TPSA:   160.79

Bound Proteins
Protein Name Uniprot ID/ACC Organism PDB ID HET Code Binding Affinity Binding Database Complex Card
Beta-lactamase Q6DRA1 (Q6DRA1_ACIBA) Acinetobacter baumannii 6TZG PKY
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