C16 H13 Cl F N3 O3
A1JGC
2-azanyl-~{N}-[(1~{R},2~{S})-2-(4-chloranyl-3-fluoranyl-phenyl)cyclopropyl]-6-nitro-benzamide
Description
Physiochemical properties
Bound structures
Interaction statistics
Ligand-specific databases
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Synonyms
2-azanyl-~{N}-[(1~{R},2~{S})-2-(4-chloranyl-3-fluoranyl-phen...Show more
Formula
Standard InChI
InChI=1S/C16H13ClFN3O3/c17-10-5-4-8(6-11(10)18)9-7-13(9)20-16(22)15-12(19)2-1-3-14(15)21(23)24/h1-6,9,13H,7,19H2,(H,20,2...Show more
Standard InChI Key
SICLOXFVNCVVMM-TVQRCGJNSA-N
SMILES
c1cc(c(c(c1)[N+](=O)[O-])C(=O)N[C@@H]2C[C@H]2c3ccc(c(c3)F)Cl...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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