C28 H18 Cl2 N2 O4
A1IP3
4-[5-chloranyl-1-(2-chlorophenyl)carbonyl-indazol-3-yl]-3-phenylmethoxy-benzoic acid
Description
Physiochemical properties
Bound structures
Interaction statistics
Ligand-specific databases
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Synonyms
4-[5-chloranyl-1-(2-chlorophenyl)carbonyl-indazol-3-yl]-3-ph...Show more
Formula
Standard InChI
InChI=1S/C28H18Cl2N2O4/c29-19-11-13-24-22(15-19)26(31-32(24)27(33)20-8-4-5-9-23(20)30)21-12-10-18(28(34)35)14-25(21)36-1...Show more
Standard InChI Key
XDNOEXMPEAPANB-UHFFFAOYSA-N
SMILES
c1ccc(cc1)COc2cc(ccc2c3c4cc(ccc4n(n3)C(=O)c5ccccc5Cl)Cl)C(=O...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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