Ligand Id: 2366
Ligand name bilobalide

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

Summary Biological activity References Structure Similar ligands
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 316405
PubChem CID 73581
Search on ChemSpider MOLPUWBMSBJXER-YDGSQGCISA-N
Wikipedia Bilobalide
ZINC ZINC08679998

Please note: some links may refer to related isomers. For more details please contact: curators@iuphar-db.org

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