hyp 9

Ligand id: 4101

Name: hyp 9

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 2
Hydrogen bond donors 3
Rotatable bonds 10
Topological polar surface area 94.83
Molecular weight 322.18
XLogP 4.55
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
1-(3-hexanoyl-2,4,6-trihydroxyphenyl)hexan-1-one
Synonyms
2,4-(1-keto-hexyl) phloroglucinol
Database Links
CAS Registry No. 3118-34-1 (source: Scifinder)
ChEMBL Ligand CHEMBL282274
PubChem CID 15659415
Search Google for chemical match using the InChIKey JRHOSBCIYWDGHN-UHFFFAOYSA-N
Search Google for chemicals with the same backbone JRHOSBCIYWDGHN
Search UniChem for chemical match using the InChIKey JRHOSBCIYWDGHN-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone JRHOSBCIYWDGHN