ATPγS

Ligand id: 1714

Name: ATPγS

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 17
Hydrogen bond donors 3
Rotatable bonds 8
Topological polar surface area 334.9
Molecular weight 518.94
XLogP -3.97
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

Classification
Compound class Metabolite or derivative
IUPAC Name
[5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl (dioxidophosphinothioyloxy-oxidophosphoryl) phosphate
Synonyms
adenosine 5'-(3-thio)triphosphate
ATPgammaS
Database Links
CAS Registry No. 35094-46-3 (source: Scifinder)
PubChem CID 44123300
Search Google for chemical match using the InChIKey NLTUCYMLOPLUHL-KQYNXXCUSA-J
Search Google for chemicals with the same backbone NLTUCYMLOPLUHL