Pyridoxamine phosphateProduct ingredient for Pyridoxamine
- Name
- Pyridoxamine phosphate
- Drug Entry
- Pyridoxamine
Pyridoxamine has been used in trials studying the treatment of Kidney Stones.
- Accession Number
- DBSALT002045
- Structure
Structure for Pyridoxamine phosphate (DBSALT002045)
- Synonyms
- Not Available
- UNII
- QWW7V29814
- CAS Number
- 84878-64-8
- Weight
- Average: 284.205
Monoisotopic: 284.077337893 - Chemical Formula
- C8H17N2O7P
- InChI Key
- XYFGQXNREWPENX-UHFFFAOYSA-N
- InChI
- InChI=1S/C8H13N2O5P.2H2O/c1-5-8(11)7(2-9)6(3-10-5)4-15-16(12,13)14;;/h3,11H,2,4,9H2,1H3,(H2,12,13,14);2*1H2
- IUPAC Name
- {[4-(aminomethyl)-5-hydroxy-6-methylpyridin-3-yl]methoxy}phosphonic acid dihydrate
- SMILES
- O.O.CC1=C(O)C(CN)=C(COP(O)(O)=O)C=N1
- External Links
- ChemSpider
- 4445529
- ChEMBL
- CHEMBL3989779
- Wikipedia
- Pyridoxamine
- Predicted Properties
Property Value Source Water Solubility 6.61 mg/mL ALOGPS logP -0.99 ALOGPS logP -2.2 Chemaxon logS -1.6 ALOGPS pKa (Strongest Acidic) 1.74 Chemaxon pKa (Strongest Basic) 9.91 Chemaxon Physiological Charge -1 Chemaxon Hydrogen Acceptor Count 6 Chemaxon Hydrogen Donor Count 4 Chemaxon Polar Surface Area 125.9 Å2 Chemaxon Rotatable Bond Count 4 Chemaxon Refractivity 56.64 m3·mol-1 Chemaxon Polarizability 22.13 Å3 Chemaxon Number of Rings 1 Chemaxon Bioavailability 1 Chemaxon Rule of Five Yes Chemaxon Ghose Filter No Chemaxon Veber's Rule No Chemaxon MDDR-like Rule No Chemaxon