C20 H23 N5 O
A1ASX
4-({4-[(3S)-3-methyl-1,4-diazepan-1-yl]quinazolin-2-yl}amino)phenol
Description
Physiochemical properties
Bound structures
Interaction statistics
Ligand-specific databases
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Synonyms
4-({4-[(3S)-3-methyl-1,4-diazepan-1-yl]quinazolin-2-yl}amino...Show more
Formula
Standard InChI
InChI=1S/C20H23N5O/c1-14-13-25(12-4-11-21-14)19-17-5-2-3-6-18(17)23-20(24-19)22-15-7-9-16(26)10-8-15/h2-3,5-10,14,21,26H...Show more
Standard InChI Key
MZXNOYZAEVMSBY-AWEZNQCLSA-N
SMILES
C[C@H]1CN(CCCN1)c2c3ccccc3nc(n2)Nc4ccc(cc4)O
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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