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Yorodumi- ChemComp-X9M: 4-tert-butyl-N-(2-methyl-3-{2-[4-(morpholine-4-carbonyl)phenyl]-1... -
+Open data
-Basic information
Entry | Database: PDB chemical components / ID: X9M |
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Name | Name: |
-Chemical information
Composition | Formula: C35H35N5O3 / Number of atoms: 78 / Formula weight: 573.684 / Formal charge: 0 | ||||
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Others | Type: non-polymer / PDB classification: HETAIN / Three letter code: X9M / Ideal coordinates details: Corina / Model coordinates PDB-ID: 7KXM | ||||
History |
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External links | UniChem / ChemSpider / ChEMBL / PubChem / SureChEMBL / Wikipedia search / Google search |
-Structure visualization
Structure viewer | Molecule: MolmilJmol/JSmol |
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-Details
-SMILES
ACDLabs 12.01 | CACTVS 3.385 | OpenEye OEToolkits 2.0.7 | |
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-SMILES CANONICAL
CACTVS 3.385 | OpenEye OEToolkits 2.0.7 | |
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-InChI
InChI 1.03 |
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-InChIKey
InChI 1.03 |
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-SYSTEMATIC NAME
ACDLabs 12.01 | OpenEye OEToolkits 2.0.7 | |
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-PDB entries
Showing all 1 items
PDB-7kxm:
BTK1 SOAKED WITH COMPOUND 5, Y551 IS SEQUESTERED