Lodoxamide tromethamineProduct ingredient for Lodoxamide

Name
Lodoxamide tromethamine
Drug Entry
Lodoxamide

Lodoxamide is a mast-cell stabilizer for topical administration into the eye. Mast-cell stabilizers, first one approved being cromolyn sodium, are used in treatment of ocular hypersensitivity reactions such as vernal conjunctivitis. These conditions often require treatment with anti-inflammatory medications such as ophthalmic NSAIDs or topical steroids which may cause systemic or toxic effects long-term. Although less effective than topical steroids at decreasing inflammation, mast-cell stabilizers offer another treatment option and exhibit minimal adverse effects. Lodoxamide is marketed under the brand name Alomide by Alcon.

Accession Number
DBSALT001178
Structure
Synonyms
Lodoxamide trometamol
UNII
50LV9A548L
CAS Number
63610-09-3
Weight
Average: 553.91
Monoisotopic: 553.1422991
Chemical Formula
C19H28ClN5O12
InChI Key
JJOFNSLZHKIJEV-UHFFFAOYSA-N
InChI
InChI=1S/C11H6ClN3O6.2C4H11NO3/c12-7-5(14-8(16)10(18)19)1-4(3-13)2-6(7)15-9(17)11(20)21;2*5-4(1-6,2-7)3-8/h1-2H,(H,14,16)(H,15,17)(H,18,19)(H,20,21);2*6-8H,1-3,5H2
IUPAC Name
bis(2-amino-2-(hydroxymethyl)propane-1,3-diol); {[3-(carboxyformamido)-2-chloro-5-cyanophenyl]carbamoyl}formic acid
SMILES
NC(CO)(CO)CO.NC(CO)(CO)CO.OC(=O)C(=O)NC1=CC(=CC(NC(=O)C(O)=O)=C1Cl)C#N
ChemSpider
9367206
ChEMBL
CHEMBL3989725
Predicted Properties
PropertyValueSource
Water Solubility0.0361 mg/mLALOGPS
logP0.72ALOGPS
logP0.83Chemaxon
logS-3.9ALOGPS
pKa (Strongest Acidic)-6.7Chemaxon
pKa (Strongest Basic)0.73Chemaxon
Physiological Charge-2Chemaxon
Hydrogen Acceptor Count7Chemaxon
Hydrogen Donor Count4Chemaxon
Polar Surface Area156.59 Å2Chemaxon
Rotatable Bond Count10Chemaxon
Refractivity69.9 m3·mol-1Chemaxon
Polarizability26.52 Å3Chemaxon
Number of Rings1Chemaxon
Bioavailability1Chemaxon
Rule of FiveNoChemaxon
Ghose FilterNoChemaxon
Veber's RuleNoChemaxon
MDDR-like RuleNoChemaxon