Rasagiline mesylateProduct ingredient for Rasagiline
- Name
- Rasagiline mesylate
- Drug Entry
- Rasagiline
Rasagiline is an irreversible inhibitor of monoamine oxidase and is used as a monotherapy in early Parkinson's disease or as an adjunct therapy in more advanced cases.
- Accession Number
- DBSALT001384
- Structure
- Synonyms
- Rasagiline (as mesilate) / Rasagiline mesilate / Rasagiline methanesulfonate
- UNII
- LH8C2JI290
- CAS Number
- 161735-79-1
- Weight
- Average: 267.34
Monoisotopic: 267.092914585 - Chemical Formula
- C13H17NO3S
- InChI Key
- JDBJJCWRXSVHOQ-UTONKHPSSA-N
- InChI
- InChI=1S/C12H13N.CH4O3S/c1-2-9-13-12-8-7-10-5-3-4-6-11(10)12;1-5(2,3)4/h1,3-6,12-13H,7-9H2;1H3,(H,2,3,4)/t12-;/m1./s1
- IUPAC Name
- (1R)-N-(prop-2-yn-1-yl)-2,3-dihydro-1H-inden-1-amine; methanesulfonic acid
- SMILES
- CS(O)(=O)=O.[H][C@]1(CCC2=CC=CC=C12)NCC#C
- External Links
- ChemSpider
- 2314552
- ChEMBL
- CHEMBL1201142
- Wikipedia
- Rasagiline
- Predicted Properties
Property Value Source Water Solubility 0.0249 mg/mL ALOGPS logP 2.26 ALOGPS logP 2.3 Chemaxon logS -3.8 ALOGPS pKa (Strongest Basic) 8.4 Chemaxon Physiological Charge 1 Chemaxon Hydrogen Acceptor Count 1 Chemaxon Hydrogen Donor Count 1 Chemaxon Polar Surface Area 12.03 Å2 Chemaxon Rotatable Bond Count 2 Chemaxon Refractivity 54.47 m3·mol-1 Chemaxon Polarizability 20.16 Å3 Chemaxon Number of Rings 2 Chemaxon Bioavailability 1 Chemaxon Rule of Five Yes Chemaxon Ghose Filter Yes Chemaxon Veber's Rule Yes Chemaxon MDDR-like Rule No Chemaxon