MRS1754

Ligand id: 449

Name: MRS1754

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 9
Hydrogen bond donors 2
Rotatable bonds 10
Topological polar surface area 131.42
Molecular weight 486.2
XLogP 3.92
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
N-(4-cyanophenyl)-2-[4-(2,6-dioxo-1,3-dipropyl-7H-purin-8-yl)phenoxy]acetamide
Synonyms
MRS-1754
Database Links
ChEMBL Ligand CHEMBL273807
PubChem CID 6603931
Search Google for chemical match using the InChIKey AJBBEYXFRYFVNM-UHFFFAOYSA-N
Search Google for chemicals with the same backbone AJBBEYXFRYFVNM
Search UniChem for chemical match using the InChIKey AJBBEYXFRYFVNM-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone AJBBEYXFRYFVNM