C7 H15 N O2
MLE
N-METHYLLEUCINE
Description
Physiochemical properties
Bound structures
Interaction statistics
Ligand-specific databases
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Synonyms
N-METHYLLEUCINE
Formula
Standard InChI
InChI=1S/C7H15NO2/c1-5(2)4-6(8-3)7(9)10/h5-6,8H,4H2,1-3H3,(H,9,10)/t6-/m0/s1
Standard InChI Key
XJODGRWDFZVTKW-LURJTMIESA-N
SMILES
CC(C)C[C@@H](C(=O)O)NC
Source OpenEye
Is part of
PRD_000142 PRD_000143 PRD_000144 PRD_000705 PRD_000764 PRD_000765 PRD_000766 PRD_000767 PRD_000768 PRD_000816 PRD_001091 PRD_001108 PRD_001122 PRD_001123 PRD_001124 PRD_001130 PRD_001132 PRD_002115 PRD_002257 PRD_002306 PRD_002323 PRD_002324 PRD_002333 PRD_002334 PRD_002335 PRD_002368 PRD_002369 PRD_002419 PRD_002456 PRD_002551 PRD_002553.
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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