dATP

Ligand id: 1760

Name: dATP

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 17
Hydrogen bond donors 6
Rotatable bonds 8
Topological polar surface area 288.33
Molecular weight 491
XLogP -5.32
No. Lipinski's rules broken 2

Molecular properties generated using the CDK

Classification
Compound class Metabolite or derivative
IUPAC Name
[(2R,3S,5R)-5-(6-aminopurin-9-yl)-3-hydroxyoxolan-2-yl]methyl (hydroxy-phosphonooxyphosphoryl) hydrogen phosphate
Synonyms
deoxyadenosine triphosphate
Database Links
BindingDB Ligand 50118233
CAS Registry No. 1927-31-7 (source: Scifinder)
ChEBI CHEBI:16284
ChEMBL Ligand CHEMBL335538
Human Metabolome Database HMDB01532
PubChem CID 15993
RCSB PDB Ligand DTP
Search Google for chemical match using the InChIKey SUYVUBYJARFZHO-RRKCRQDMSA-N
Search Google for chemicals with the same backbone SUYVUBYJARFZHO
Wikipedia Deoxyadenosine_triphosphate