Ligand Id: 1666
Ligand name salvinorin A

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 7
Hydrogen bond donors 0
Rotatable bonds 5
Topological polar surface area 109.11
Molecular weight 432.18
XLogP 2.38
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Summary Biological activity References Structure Suppliers
Compound class Natural product or derivative
methyl (2S,4aR,6aR,7R,9S,10aS,10bR)-9-acetyloxy-2-furan-3-yl-6a,10b-dimethyl-4,10-dioxo-2,4a,5,6,7,8,9,10a-octahydro-1H-benzo[f]isochromene-7-carboxylate
divinorin A
Database Links
BindingDB Ligand 50159165
ChEMBL Ligand CHEMBL445332
PubChem CID 128563
Search Google for chemical match using the InChIKey OBSYBRPAKCASQB-AGQYDFLVSA-N
Search Google for chemicals with the same backbone OBSYBRPAKCASQB
Wikipedia Salvinorin_A
ZINC ZINC13607514

Contact us | Print | Back to top | Help