UNC0642

Ligand id: 7017

Name: UNC0642

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 6
Hydrogen bond donors 1
Rotatable bonds 10
Topological polar surface area 65.99
Molecular weight 546.35
XLogP 4.34
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
2-(4,4-difluoropiperidin-1-yl)-6-methoxy-N-(1-propan-2-ylpiperidin-4-yl)-7-(3-pyrrolidin-1-ylpropoxy)quinazolin-4-amine
Database Links
ChEMBL Ligand CHEMBL2441082
PubChem CID 53315878
Search Google for chemical match using the InChIKey RNAMYOYQYRYFQY-UHFFFAOYSA-N
Search Google for chemicals with the same backbone RNAMYOYQYRYFQY
Search UniChem for chemical match using the InChIKey RNAMYOYQYRYFQY-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone RNAMYOYQYRYFQY
Comments
UNCO0642 is compound 7 in [1]. This is a compound from the Structural Genomics Consortium's (SGC) Epigenetics Probes Collection.