TP-064

Ligand id: 9528

Name: TP-064

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 5
Hydrogen bond donors 1
Rotatable bonds 10
Topological polar surface area 57.7
Molecular weight 458.27
XLogP 5.22
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
N-methyl-N-[[2-[1-[2-(methylamino)ethyl]piperidin-4-yl]pyridin-4-yl]methyl]-3-phenoxybenzamide
Synonyms
TP 064
Comments
TP-064 is a potent, selective and cell active chemical probe for PRMT4 (officially known as coactivator associated arginine methyltransferase 1; CARM1) [1]. It is one of the chemical tools in the Structural Genomics Consortium's Epigenetic Probes Collection and was developed in collaboration with Takeda.
Database Links
GtoPdb PubChem SID 336446914
PubChem CID 122707126
RCSB PDB Ligand 7VM
Search Google for chemical match using the InChIKey VUIITYLFSAXKIQ-UHFFFAOYSA-N
Search Google for chemicals with the same backbone VUIITYLFSAXKIQ
Search UniChem for chemical match using the InChIKey VUIITYLFSAXKIQ-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone VUIITYLFSAXKIQ

Product suppliers

Tocris
TP 064
Cat. No. 6008