C41 H51 N7 O7
A1DF0
peptide PA9
Description
Physiochemical properties
Bound structures
Interaction statistics
Ligand-specific databases
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Synonyms
N-{(2S)-2-cyclohexyl-2-[(pyrazine-2-carbonyl)amino]acetyl}-L...Show more
Formula
Standard InChI
InChI=1S/C41H51N7O7/c1-2-13-30(36(49)46-32(41(54)55)25-28-16-8-4-9-17-28)44-38(51)34-20-12-23-48(34)40(53)31(24-27-14-6-...Show more
Standard InChI Key
OWUJPUTWBSNDCO-SEVYIBDJSA-N
SMILES
CCC[C@@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)O)NC(=O)[C@@H]2CCCN2C(...Show more
Source OpenEye
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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