A2P5P

Ligand id: 1717

Name: A2P5P

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 15
Hydrogen bond donors 6
Rotatable bonds 6
Topological polar surface area 252.22
Molecular weight 427.03
XLogP -5.13
No. Lipinski's rules broken 2

Molecular properties generated using the CDK

Classification
Compound class Metabolite or derivative
IUPAC Name
[(2R,3R,4R,5R)-2-(6-aminopurin-9-yl)-4-hydroxy-5-(phosphonooxymethyl)oxolan-3-yl] dihydrogen phosphate
Synonyms
2,5-ADP
adenosine 2',5'-bisphosphate
adenosine-2'-5'-diphosphate
Database Links
BindingDB Ligand 11941
CAS Registry No. 3805-37-6 (source: Scifinder)
ChEMBL Ligand CHEMBL1161861
PubChem CID 440141
RCSB PDB Ligand A2P
Search Google for chemical match using the InChIKey AEOBEOJCBAYXBA-KQYNXXCUSA-N
Search Google for chemicals with the same backbone AEOBEOJCBAYXBA