leucettine L41

Ligand id: 8167

Name: leucettine L41

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 4
Hydrogen bond donors 2
Rotatable bonds 3
Topological polar surface area 71.95
Molecular weight 307.1
XLogP 3.74
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
(5Z)-2-anilino-5-(1,3-benzodioxol-5-ylmethylidene)-1H-imidazol-4-one
Database Links
CAS Registry No. 1112978-84-3
ChEMBL Ligand CHEMBL1802358
PubChem CID 25230621
Search Google for chemical match using the InChIKey PGPHHJBZEGSUNE-JYRVWZFOSA-N
Search Google for chemicals with the same backbone PGPHHJBZEGSUNE
Search UniChem for chemical match using the InChIKey PGPHHJBZEGSUNE-JYRVWZFOSA-N
Search UniChem for chemicals with the same backbone PGPHHJBZEGSUNE
Comments
Leucettine L41 is a synthetic analogue of the marine sponge derived compound leucettine B [1]. The leucettines act as inhibitors of two families of serine/threonine kinases; dual-specificity, tyrosine phosphorylation-regulated kinases (DYRKs), and cdc2-like kinases (CLKs), which are involved in Alzheimer’sdisease/Down syndrome and in the control of alternative pre-mRNA splicing.