MRS2365

Ligand id: 3338

Name: MRS2365

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 14
Hydrogen bond donors 3
Rotatable bonds 10
Topological polar surface area 235.29
Molecular weight 548.98
XLogP -1.66
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
[(1R,2R,3S,5S)-4-[6-amino-2-(methylsulfanyl)-9H-purin-9-yl]-2,3-dihydroxybicyclo[3.1.0]hexan-1-yl]methyl sodium {[bis(sodiooxy)phosphoryl]oxy}phosphonate
Synonyms
(N)-methanocarba-2-MeSADP | MRS 2365
Database Links
CAS Registry No. 436847-09-5 (source: Scifinder)
PubChem CID 73755043
Search Google for chemical match using the InChIKey ZYPJOXVKTCEBCA-PVMCGCOJSA-K
Search Google for chemicals with the same backbone ZYPJOXVKTCEBCA
Search UniChem for chemical match using the InChIKey ZYPJOXVKTCEBCA-PVMCGCOJSA-K
Search UniChem for chemicals with the same backbone ZYPJOXVKTCEBCA