HC030031

Ligand id: 4211

Name: HC030031

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 8
Hydrogen bond donors 1
Rotatable bonds 5
Topological polar surface area 87.54
Molecular weight 355.16
XLogP 2.49
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
2-(1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-7-yl)-N-[4-(propan-2-yl)phenyl]acetamide
Synonyms
HC-030031
Database Links
CAS Registry No. 349085-38-7 (source: SciFinder)
ChEMBL Ligand CHEMBL1086310
PubChem CID 1150897
Search Google for chemical match using the InChIKey HEQDZPHDVAOBLN-UHFFFAOYSA-N
Search Google for chemicals with the same backbone HEQDZPHDVAOBLN
Search UniChem for chemical match using the InChIKey HEQDZPHDVAOBLN-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone HEQDZPHDVAOBLN