PSB-0788

Ligand id: 6561

Name: PSB-0788

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 10
Hydrogen bond donors 2
Rotatable bonds 7
Topological polar surface area 127.09
Molecular weight 542.15
XLogP 3.32
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
8-(4-{4-[(4-chlorophenyl)methyl]piperazine-1-sulfonyl}phenyl)-1-propyl-2,3,6,7-tetrahydro-1H-purine-2,6-dione
Synonyms
PSB 0788 | PSB0788
Database Links
ChEMBL Ligand CHEMBL482436
PubChem CID 44186581
Search Google for chemical match using the InChIKey JQZJACVYMPKVDS-UHFFFAOYSA-N
Search Google for chemicals with the same backbone JQZJACVYMPKVDS
Search UniChem for chemical match using the InChIKey JQZJACVYMPKVDS-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone JQZJACVYMPKVDS