tedizolid   Click here for help

GtoPdb Ligand ID: 10865

Synonyms: DA-7157 | previously torezolid | Sivextro® | TR-700 | TR700
Approved drug PDB Ligand
tedizolid is an approved drug (FDA (2014), EMA (2015))
Compound class: Synthetic organic
Comment: Tedizolid is an oxazolidinone antiobiotic [1].
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2D Structure
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Physico-chemical Properties
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Hydrogen bond acceptors 8
Hydrogen bond donors 1
Rotatable bonds 4
Topological polar surface area 106.26
Molecular weight 370.12
XLogP 1.9
No. Lipinski's rules broken 0
SMILES / InChI / InChIKey
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Canonical SMILES OC[C@@H]1OC(=O)N(C1)c1ccc(c(c1)F)c1ccc(nc1)c1nnn(n1)C
Isomeric SMILES OC[C@@H]1OC(=O)N(C1)c1ccc(c(c1)F)c1ccc(nc1)c1nnn(n1)C
InChI InChI=1S/C17H15FN6O3/c1-23-21-16(20-22-23)15-5-2-10(7-19-15)13-4-3-11(6-14(13)18)24-8-12(9-25)27-17(24)26/h2-7,12,25H,8-9H2,1H3/t12-/m1/s1
InChI Key XFALPSLJIHVRKE-GFCCVEGCSA-N
Classification Click here for help
Compound class Synthetic organic
Approved drug? Yes (FDA (2014), EMA (2015))
IUPAC Name Click here for help
(5R)-3-[3-fluoro-4-[6-(2-methyltetrazol-5-yl)pyridin-3-yl]phenyl]-5-(hydroxymethyl)-1,3-oxazolidin-2-one
International Nonproprietary Names Click here for help
INN number INN
9136 tedizolid
Synonyms Click here for help
DA-7157 | previously torezolid | Sivextro® | TR-700 | TR700
Database Links Click here for help
Specialist databases
Antibiotic DB Antibiotic DB Database logo 167
Other databases
CAS Registry No. 856866-72-3 (source: WHO INN record)
ChEMBL Ligand CHEMBL1257051
DrugBank Ligand DB14569
GtoPdb PubChem SID 405560306
PubChem CID 11234049
RCSB PDB Ligand U7V
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