MRS2179

Ligand id: 1720

Name: MRS2179

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 14
Hydrogen bond donors 3
Rotatable bonds 7
Topological polar surface area 223.66
Molecular weight 423.03
XLogP -3.71
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
[2-[(hydroxy-oxidophosphoryl)oxymethyl]-5-(6-methylaminopurin-9-yl)oxolan-3-yl] hydrogen phosphate
Synonyms
MRS-2179
Database Links
CAS Registry No. 101204-49-3 (source: Scifinder)
PubChem CID 24867852
Search Google for chemical match using the InChIKey CCPLITQNIFLYQB-XLPZGREQSA-L
Search Google for chemicals with the same backbone CCPLITQNIFLYQB
Search UniChem for chemical match using the InChIKey CCPLITQNIFLYQB-XLPZGREQSA-L
Search UniChem for chemicals with the same backbone CCPLITQNIFLYQB