UNC0321

Ligand id: 8389

Name: UNC0321

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 8
Hydrogen bond donors 1
Rotatable bonds 11
Topological polar surface area 78.46
Molecular weight 515.36
XLogP 1.01
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
7-[2-[2-(dimethylamino)ethoxy]ethoxy]-6-methoxy-2-(4-methyl-1,4-diazepan-1-yl)-N-(1-methylpiperidin-4-yl)quinazolin-4-amine
Synonyms
UNC 0321 | UNC-0321
Database Links
CAS Registry No. 1238673-32-9
ChEMBL Ligand CHEMBL1214066
PubChem CID 46901937
Search Google for chemical match using the InChIKey AULLUGALUBVBDD-UHFFFAOYSA-N
Search Google for chemicals with the same backbone AULLUGALUBVBDD
Search UniChem for chemical match using the InChIKey AULLUGALUBVBDD-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone AULLUGALUBVBDD
Comments
UNC0321 was the first reported picomolar inhibitor of the histone methyltransferase, G9a (eq. euchromatic histone-lysine N-methyltransferase 2, EHMT2) [3]. G9a catalyses methylation of lysine 9 of histone H3 (H3K9) and lysine 373 (K373) of the tumour suppressor, p53 [1], and is reported to be overexpressed in human cancers.