cefonicid Report issue

Small molecule Approved FDA
ChEMBL DrugBank Drug Central Drugs@FDA KEGG MeSH PubChem repoDB

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Chemistry

Mol. Mass

542.58

ALogP

-0.92

Rule of 5

No

Rule of 3

No
Details
  • SMILES: O=C(O)C1=C(CSc2nnnn2CS(=O)(=O)O)CS[C@@H]2[C@H](NC(=O)[C@H](O)c3ccccc3)C(=O)N12
  • InChIKey: DYAIAHUQIPBDIP-AXAPSJFSSA-N
    InChI=1S/C18H18N6O8S3/c25-13(9-4-2-1-3-5-9)14(26)19-11-15(27)24-12(17(28)29)10(6-33-16(11)24)7-34-18-20-21-22-23(18)8-35(30,31)32/h1-5,11,13,16,25H,6-8H2,(H,19,26)(H,28,29)(H,30,31,32)/t11-,13-,16-/m1/s1
  • Chirality: Single Stereoisomer
  • Inorganic: No
  • Polymer: No

Sources

CHEMBL1601   ChEMBL
cefonicid *

CHEMBL1201005   ChEMBL
cefonicid sodium

6532B86WFG   NCATS
cefonicid *

Cefonicid   Wikipedia

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