C12 H12 N2 O4
ME9
1,1'-butane-1,4-diylbis(1H-pyrrole-2,5-dione)
Description
Physiochemical properties
Bound structures
Interaction statistics
Ligand-specific databases
Synonyms
1,1'-butane-1,4-diylbis(1H-pyrrole-2,5-dione)
Formula
Standard InChI
InChI=1S/C12H12N2O4/c15-9-3-4-10(16)13(9)7-1-2-8-14-11(17)5-6-12(14)18/h3-6H,1-2,7-8H2
Standard InChI Key
WXXSHAKLDCERGU-UHFFFAOYSA-N
SMILES
C1=CC(=O)N(C1=O)CCCCN2C(=O)C=CC2=O
Source OpenEye
Is part of
First observed in
Overall view, and highlighted
scaffolds and fragments ![help icon]()
This image gallery displays several views of the ligand structure:
- Basic Structural Representation: Shows the overall structure of the ligand.
- Detailed Structural Representation: Highlights individual atoms within the ligand.
- Murcko Scaffold: Presents the scaffold of the ligand highlighted in yellow.
- Highlighted Fragments: Displays various ligand fragments, highlighted in yellow.
This image gallery displays several views of the ligand structure:
- Basic Structural Representation: Shows the overall structure of the ligand.
- Detailed Structural Representation: Highlights individual atoms within the ligand.
- Murcko Scaffold: Presents the scaffold of the ligand highlighted in yellow.
- Highlighted Fragments: Displays various ligand fragments, highlighted in yellow.
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