2-thioUTP

Ligand id: 3398

Name: 2-thioUTP

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 16
Hydrogen bond donors 7
Rotatable bonds 8
Topological polar surface area 303.37
Molecular weight 499.95
XLogP -5.18
No. Lipinski's rules broken 2

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
[(2R,3S,4R,5R)-3,4-dihydroxy-5-(4-oxo-2-sulfanylidenepyrimidin-1-yl)oxolan-2-yl]methyl (hydroxy-phosphonooxyphosphoryl) hydrogen phosphate
Synonyms
2-thio-UTP
Database Links
CAS Registry No. 35763-29-2 (source: Scifinder)
ChEMBL Ligand CHEMBL217803
PubChem CID 10174453
Search Google for chemical match using the InChIKey KHYOUGAATNYCAZ-XVFCMESISA-N
Search Google for chemicals with the same backbone KHYOUGAATNYCAZ
Search UniChem for chemical match using the InChIKey KHYOUGAATNYCAZ-XVFCMESISA-N
Search UniChem for chemicals with the same backbone KHYOUGAATNYCAZ