Ligand Id: 306
Ligand name sabcomeline

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 2
Hydrogen bond donors 0
Rotatable bonds 2
Topological polar surface area 48.62
Molecular weight 193.12
XLogP 0.6
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Summary Biological activity References Structure Similar ligands
Classification
Compound class Synthetic organic
IUPAC Name
(Z,3R)-1-azabicyclo[2.2.2]oct-3-carbonimidoyl cyanide
Synonyms
(2Z)-2-(1-azabicyclo[2.2.2]oct-8-yl)-2-methoxyimino-acetonitrile
(3R)-N-methoxyquinuclidine-3-carboximidoyl cyanide
(8Z,8R)-N-methoxy-1-azabicyclo[2.2.2]octane-8-carboximidoyl cyanide
(R)-1-Aza-bicyclo[2.2.2]oct-3-yl-[(Z)-methoxyimino]-acetonitrile
(R-(Z)-(+)-α-(methoxyimino)-1-azabicyclo[2.2.2] octane-3-acetonitrile)
SB-202026
Database Links
BindingDB Ligand 50061705
CAS Registry No. 159912-53-5 (source: Scifinder)
ChEBI CHEBI:324085
ChEMBL Ligand 324171, 324084, 324085, 324125
PubChem CID 9577995
Search on ChemSpider IQWCBYSUUOFOMF-QTLFRQQHSA-N
Wikipedia Sabcomeline
ZINC ZINC53041013
iPHACE ADB5DQ24

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

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