etalocib

Ligand id: 2948

Name: etalocib

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 2
Hydrogen bond donors 2
Rotatable bonds 13
Topological polar surface area 85.22
Molecular weight 544.23
XLogP 9.08
No. Lipinski's rules broken 2

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
2-[3-[3-[2-ethyl-4-(4-fluorophenyl)-5-hydroxyphenoxy]propoxy]-2-propylphenoxy]benzoic acid
International Nonproprietary Names
INN number INN
8360 etalocib
Synonyms
LY 293111 | VML 295
Database Links
CAS Registry No. 161172-51-6 (source: Scifinder)
ChEMBL Ligand CHEMBL329123
PubChem CID 177941
Search Google for chemical match using the InChIKey YFIZRWPXUYFCSN-UHFFFAOYSA-N
Search Google for chemicals with the same backbone YFIZRWPXUYFCSN
Search PubMed clinical trials etalocib
Search PubMed titles etalocib
Search PubMed titles/abstracts etalocib
Search UniChem for chemical match using the InChIKey YFIZRWPXUYFCSN-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone YFIZRWPXUYFCSN
Wikipedia Etalocib