lodoxamide   Click here for help

GtoPdb Ligand ID: 9743

Synonyms: Alomide®
Approved drug PDB Ligand Immunopharmacology Ligand
lodoxamide is an approved drug (UK (1991), FDA (1993))
Compound class: Synthetic organic
Comment: Lodoxamide is a mast cell stabilizing anti-inflammatory drug. Clinically administered forms may contain lodoxamide trometamol/tromethamine.
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2D Structure
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Physico-chemical Properties
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Hydrogen bond acceptors 9
Hydrogen bond donors 4
Rotatable bonds 6
Topological polar surface area 156.59
Molecular weight 310.99
XLogP -0.34
No. Lipinski's rules broken 0
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Canonical SMILES N#Cc1cc(NC(=O)C(=O)O)c(c(c1)NC(=O)C(=O)O)Cl
Isomeric SMILES N#Cc1cc(NC(=O)C(=O)O)c(c(c1)NC(=O)C(=O)O)Cl
InChI InChI=1S/C11H6ClN3O6/c12-7-5(14-8(16)10(18)19)1-4(3-13)2-6(7)15-9(17)11(20)21/h1-2H,(H,14,16)(H,15,17)(H,18,19)(H,20,21)
Classification Click here for help
Compound class Synthetic organic
Approved drug? Yes (UK (1991), FDA (1993))
IUPAC Name Click here for help
2-[[2-chloro-5-cyano-3-(oxaloamino)phenyl]amino]-2-oxoacetic acid
International Nonproprietary Names Click here for help
INN number INN
4351 lodoxamide
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Database Links Click here for help
Specialist databases
GPCRdb Ligand lodoxamide
Other databases
CAS Registry No. 53882-12-5 (source: WHO INN record)
ChEMBL Ligand CHEMBL1201266
DrugCentral Ligand 3325
GtoPdb PubChem SID 354702216
PubChem CID 44564
Search Google for chemical match using the InChIKey RVGLGHVJXCETIO-UHFFFAOYSA-N
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UniChem Compound Search for chemical match using the InChIKey RVGLGHVJXCETIO-UHFFFAOYSA-N
UniChem Connectivity Search for chemical match using the InChIKey RVGLGHVJXCETIO-UHFFFAOYSA-N