bilobalide

Ligand id: 2366

Name: bilobalide

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 8
Hydrogen bond donors 2
Rotatable bonds 1
Topological polar surface area 119.36
Molecular weight 326.1
XLogP -0.17
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Natural product or derivative
IUPAC Name
(1S,4R,7R,8S,9R,11S)-9-tert-butyl-7,9-dihydroxy-3,5,12-trioxatetracyclo[6.6.0.0^{1,11}.0^{4,8}]tetradecane-2,6,13-trione
Database Links
CAS Registry No. 33570-04-6 (source: Scifinder)
ChEBI CHEBI:3103
ChEMBL Ligand CHEMBL1318117
PubChem CID 73581
Search Google for chemical match using the InChIKey MOLPUWBMSBJXER-YDGSQGCISA-N
Search Google for chemicals with the same backbone MOLPUWBMSBJXER
Wikipedia Bilobalide