C17 H18 Cl N5 O2
KA5
5-chloro-N~6~-(2,5-dimethoxybenzyl)quinazoline-2,4,6-triamine
Description
Physiochemical properties
Bound structures
Interaction statistics
Ligand-specific databases
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Synonyms
5-chloro-N~6~-(2,5-dimethoxybenzyl)quinazoline-2,4,6-triamin...Show more
Formula
Standard InChI
InChI=1S/C17H18ClN5O2/c1-24-10-3-6-13(25-2)9(7-10)8-21-12-5-4-11-14(15(12)18)16(19)23-17(20)22-11/h3-7,21H,8H2,1-2H3,(H4...Show more
Standard InChI Key
ZQYDKYDSKVGDJP-UHFFFAOYSA-N
SMILES
COc1ccc(c(c1)CNc2ccc3c(c2Cl)c(nc(n3)N)N)OC
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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