hexestrol

Ligand id: 2823

Name: hexestrol

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 0
Hydrogen bond donors 2
Rotatable bonds 5
Topological polar surface area 40.46
Molecular weight 270.16
XLogP 6.55
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
4-[4-(4-hydroxyphenyl)hexan-3-yl]phenol
International Nonproprietary Names
INN number INN
2074 hexestrol
Database Links
CAS Registry No. 5635-50-7 (source: Scifinder)
ChEMBL Ligand CHEMBL6615
PubChem CID 3606
Search Google for chemical match using the InChIKey PBBGSZCBWVPOOL-UHFFFAOYSA-N
Search Google for chemicals with the same backbone PBBGSZCBWVPOOL
Search PubMed clinical trials hexestrol
Search PubMed titles hexestrol
Search PubMed titles/abstracts hexestrol
Search UniChem for chemical match using the InChIKey PBBGSZCBWVPOOL-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone PBBGSZCBWVPOOL