C19 H12 Cl N5 O
A1KBF
6-chloranyl-3-[4-(1~{H}-indol-3-yl)-1~{H}-pyrazol-5-yl]quinazolin-4-one
Description
Physiochemical properties
Bound structures
Interaction statistics
Ligand-specific databases
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Synonyms
6-chloranyl-3-[4-(1~{H}-indol-3-yl)-1~{H}-pyrazol-5-yl]quina...Show more
Formula
Standard InChI
InChI=1S/C19H12ClN5O/c20-11-5-6-17-13(7-11)19(26)25(10-22-17)18-15(9-23-24-18)14-8-21-16-4-2-1-3-12(14)16/h1-10,21H,(H,2...Show more
Standard InChI Key
SZKXRZQREVWXRK-UHFFFAOYSA-N
SMILES
c1ccc2c(c1)c(c[nH]2)c3cn[nH]c3N4C=Nc5ccc(cc5C4=O)Cl
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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