cefpodoxime   Click here for help

GtoPdb Ligand ID: 10780

Synonyms: RU-51746 | Vantin®
Approved drug
cefpodoxime is an approved drug (FDA (1992))
Compound class: Synthetic organic
Comment: Cefpodoxime (proxetil) is a broad-spectrum, oral, third generation cephalosporin antibacterial that is active against most Gram-positive and Gram-negative bacteria [1].
2D Structure
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Physico-chemical Properties
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Hydrogen bond acceptors 9
Hydrogen bond donors 3
Rotatable bonds 8
Topological polar surface area 209.98
Molecular weight 427.06
XLogP -2.93
No. Lipinski's rules broken 0
SMILES / InChI / InChIKey
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Canonical SMILES CO/N=C(/c1csc(n1)N)\C(=O)N[C@H]1[C@H]2SCC(=C(N2C1=O)C(=O)O)COC
Isomeric SMILES CO/N=C(/c1csc(n1)N)\C(=O)N[C@H]1[C@H]2SCC(=C(N2C1=O)C(=O)O)COC
InChI InChI=1S/C15H17N5O6S2/c1-25-3-6-4-27-13-9(12(22)20(13)10(6)14(23)24)18-11(21)8(19-26-2)7-5-28-15(16)17-7/h5,9,13H,3-4H2,1-2H3,(H2,16,17)(H,18,21)(H,23,24)/b19-8-/t9-,13-/m1/s1
InChI Key WYUSVOMTXWRGEK-HBWVYFAYSA-N
Bioactivity Comments
MIC50 against penicillin-susceptible Streptococcus pneumoniae is 0.03 μg/ml [2].