C26 H34 F N5 O5 S
A1JS2
[7-fluoranyl-1-[(3~{R})-1-(2-morpholin-4-ylethyl)piperidin-3-yl]-5,5-bis(oxidanylidene)-4~{H}-thiochromeno[4,3-c]pyrazol-3-yl]-morpholin-4-yl-methanone
Description
Physiochemical properties
Bound structures
Interaction statistics
Ligand-specific databases
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Synonyms
[7-fluoranyl-1-[(3~{R})-1-(2-morpholin-4-ylethyl)piperidin-3...Show more
Formula
Standard InChI
InChI=1S/C26H34FN5O5S/c27-19-3-4-21-23(16-19)38(34,35)18-22-24(26(33)31-10-14-37-15-11-31)28-32(25(21)22)20-2-1-5-30(17-...Show more
Standard InChI Key
AVPAAQMVQVGYGP-HXUWFJFHSA-N
SMILES
c1cc-2c(cc1F)S(=O)(=O)Cc3c2n(nc3C(=O)N4CCOCC4)[C@@H]5CCCN(C5...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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