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Yorodumi- ChemComp-NQ5: 2-methoxy-~{N}-[2-methoxy-5-[7-[[(2~{R})-4-(oxetan-3-yl)morpholin... -
+Open data
-Basic information
Entry | Database: PDB chemical components / ID: NQ5 |
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Name | Name: |
-Chemical information
Composition | Formula: C25H33N3O8S / Number of atoms: 70 / Formula weight: 535.61 / Formal charge: 0 | ||||
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Others | Type: non-polymer / PDB classification: HETAIN / Three letter code: NQ5 / Ideal coordinates details: Corina / Model coordinates PDB-ID: 6TNS | ||||
History |
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External links | UniChem / BindingDB / ChEMBL / GtoPharmacology / PubChem / ChemSpider / Wikipedia search / Google search |
-Structure visualization
Structure viewer | Molecule: MolmilJmol/JSmol |
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-Details
-SMILES
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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-PDB entries
Showing all 1 items
PDB-6tns:
PI3K delta in complex with 2methoxyN[2methoxy5(7{[(2R)4(oxetan3 yl)morpholin2yl]methoxy}1,3dihydro2 benzofuran5yl)pyridin3yl]ethane1 sulfonamide