PD123319

Ligand id: 597

Name: PD123319

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 7
Hydrogen bond donors 1
Rotatable bonds 8
Topological polar surface area 78.67
Molecular weight 508.25
XLogP 7.9
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
(6S)-1-[(4-dimethylamino-3-methylphenyl)methyl]-5-[2,2-di(phenyl)acetyl]-6,7-dihydro-4H-imidazo[5,4-d]pyridine-6-carboxylic acid
Synonyms
PD 123319 | PD-123319
Database Links
BindingDB Ligand 50010338
CAS Registry No. 130663-39-7 (source: Scifinder)
ChEBI CHEBI:61014
ChEMBL Ligand CHEMBL321820
PubChem CID 5311345
Search Google for chemical match using the InChIKey YSTVFDAKLDMYCR-NDEPHWFRSA-N
Search Google for chemicals with the same backbone YSTVFDAKLDMYCR
Search UniChem for chemical match using the InChIKey YSTVFDAKLDMYCR-NDEPHWFRSA-N
Search UniChem for chemicals with the same backbone YSTVFDAKLDMYCR