TBPS

Ligand Id: 4320
Ligand name TBPS

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 3
Hydrogen bond donors 0
Rotatable bonds 1
Topological polar surface area 69.59
Molecular weight 222.05
XLogP 3.15
No. Lipinski's rules broken 0

Molecular properties generated using the CDK


Classification
Compound class Synthetic organic
IUPAC Name
4-tert-butyl-2,6,7-trioxa-1$l^{5}-phosphabicyclo[2.2.2]octane-1-thione
Synonyms
tert-butylbicyclophosphorothionate
Database Links
CAS Registry No. 70636-86-1 (source: Scifinder)
ChEMBL Ligand CHEMBL485673
PubChem CID 104781
Search Google for chemical match using the InChIKey VTBHBNXGFPTBJL-UHFFFAOYSA-N
Search Google for chemicals with the same backbone VTBHBNXGFPTBJL