Zoledronate disodiumProduct ingredient for Zoledronic acid
- Name
- Zoledronate disodium
- Drug Entry
- Zoledronic acid
Zoledronic acid, or CGP 42'446,8 is a third generation, nitrogen containing bisphosphonate similar to ibandronic acid, minodronic acid, and risedronic acid.5 Zoledronic acid is used to treat and prevent multiple forms of osteoporosis, hypercalcemia of malignancy, multiple myeloma, bone metastases from solid tumors, and Paget’s disease of bone.14,15,16 Zoledronic acid was first described in the literature in 1994.8
Zoledronic acid was granted FDA approval on 20 August 2001.14
- Accession Number
- DBSALT001757
- Structure
Structure for Zoledronate disodium (DBSALT001757)
- Synonyms
- Not Available
- UNII
- 7D7GS1SA24
- CAS Number
- 165800-07-7
- Weight
- Average: 388.113
Monoisotopic: 388.0024719 - Chemical Formula
- C5H16N2Na2O11P2
- InChI Key
- IEJZOPBVBXAOBH-UHFFFAOYSA-L
- InChI
- InChI=1S/C5H10N2O7P2.2Na.4H2O/c8-5(15(9,10)11,16(12,13)14)3-7-2-1-6-4-7;;;;;;/h1-2,4,8H,3H2,(H2,9,10,11)(H2,12,13,14);;;4*1H2/q;2*+1;;;;/p-2
- IUPAC Name
- disodium tetrahydrate hydrogen [1-hydrogen phosphono-1-hydroxy-2-(1H-imidazol-1-yl)ethyl]phosphonate
- SMILES
- O.O.O.O.[Na+].[Na+].OC(CN1C=CN=C1)(P(O)([O-])=O)P(O)([O-])=O
- External Links
- ChemSpider
- 19986753
- ChEMBL
- CHEMBL2103912
- Predicted Properties
Property Value Source Water Solubility 5.43 mg/mL ALOGPS logP -0.52 ALOGPS logP -3.9 Chemaxon logS -1.8 ALOGPS pKa (Strongest Acidic) 0.66 Chemaxon pKa (Strongest Basic) 6.68 Chemaxon Physiological Charge -3 Chemaxon Hydrogen Acceptor Count 8 Chemaxon Hydrogen Donor Count 3 Chemaxon Polar Surface Area 158.77 Å2 Chemaxon Rotatable Bond Count 4 Chemaxon Refractivity 49.91 m3·mol-1 Chemaxon Polarizability 19.4 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