C29 H31 Cl2 N3 O4
A1CSR
3-(4-chlorophenoxy)-N-{(1r,4r)-4-[2-(4-chlorophenoxy)acetamido]cyclohexyl}-N-[(pyridin-4-yl)methyl]propanamide
Description
Physiochemical properties
Bound structures
Interaction statistics
Ligand-specific databases
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Synonyms
3-(4-chlorophenoxy)-N-{(1r,4r)-4-[2-(4-chlorophenoxy)acetami...Show more
Formula
Standard InChI
InChI=1S/C29H31Cl2N3O4/c30-22-1-9-26(10-2-22)37-18-15-29(36)34(19-21-13-16-32-17-14-21)25-7-5-24(6-8-25)33-28(35)20-38-2...Show more
Standard InChI Key
ZSKCSXHRUVZRGU-SOAUALDESA-N
SMILES
c1cc(ccc1OCCC(=O)N(Cc2ccncc2)C3CCC(CC3)NC(=O)COc4ccc(cc4)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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