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Yorodumi- ChemComp-BA0: (7S)-2-(4-phenoxyphenyl)-7-(1-propanoylpiperidin-4-yl)-4,5,6,7-te... -
+Open data
-Basic information
Entry | Database: PDB chemical components / ID: BA0 | ||||
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Name | Name: ( Synonyms: Zanubrutinib Wikipedia | Wikipedia - Zanubrutinib: |
Zanubrutinib, sold under the brand name Brukinsa, is an anticancer medication used for the treatment of mantle cell lymphoma (MCL), Waldenström's macroglobulinemia (WM), marginal zone lymphoma (MZL), and chronic lymphocytic leukemia (CLL). Zanubrutinib is classified as a Bruton's tyrosine kinase (BTK) inhibitor... Comment | medication, anticancer, inhibitor*YM | |
-Chemical information
Composition | Formula: C27H31N5O3 / Number of atoms: 66 / Formula weight: 473.567 / Formal charge: 0 | ||||||
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Others | Type: NON-POLYMER / PDB classification: HETAIN / Three letter code: BA0 / Ideal coordinates details: Corina / Model coordinates PDB-ID: 6J6M | ||||||
History |
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External links | UniChem / PubChem / ChemSpider / 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 2.0.6 | |
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-SMILES CANONICAL
CACTVS 3.385 | OpenEye OEToolkits 2.0.6 | |
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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 2.0.6 | ( | |
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-PDB entries
Showing all 1 items
PDB-6j6m:
Co-crystal structure of BTK kinase domain with Zanubrutinib