compound 2e [PMID: 7629799]

Ligand id: 3064

Name: compound 2e [PMID: 7629799]

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 6
Hydrogen bond donors 4
Rotatable bonds 11
Topological polar surface area 134.68
Molecular weight 368.15
XLogP 2.34
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
[(7E)-8,12-dimethyl-1-phosphonotrideca-7,11-dien-1-yl]phosphonic acid
Database Links
ChEMBL Ligand CHEMBL87199
PubChem CID 10339001
Search Google for chemical match using the InChIKey YCVCYJHGGKYDRH-GXDHUFHOSA-N
Search Google for chemicals with the same backbone YCVCYJHGGKYDRH
Search UniChem for chemical match using the InChIKey YCVCYJHGGKYDRH-GXDHUFHOSA-N
Search UniChem for chemicals with the same backbone YCVCYJHGGKYDRH