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Yorodumi- ChemComp-WTF: [2-(ethylsulfonyl)phenyl][(2S)-4-(6-fluoro-1,3-benzothiazol-2-yl)... -
+Open data
-Basic information
Entry | Database: PDB chemical components / ID: WTF |
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Name | Name: [ |
-Chemical information
Composition | Formula: C21H22FN3O3S2 / Number of atoms: 52 / Formula weight: 447.546 / Formal charge: 0 | ||||||
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Others | Type: NON-POLYMER / PDB classification: HETAIN / Three letter code: WTF / Ideal coordinates details: Corina / Model coordinates PDB-ID: 6DXX | ||||||
History |
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External links | UniChem / BindingDB / Brenda / ChEMBL / GtoPharmacology / PubChem / SureChEMBL / 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 2 items
PDB-6dxx:
Human N-acylethanolamine-hydrolyzing acid amidase (NAAA) in complex with non-covalent benzothiazole-piperazine inhibitor ARN19702, in presence of Triton X-100
PDB-6dxz:
Rabbit N-acylethanolamine-hydrolyzing acid amidase (NAAA) in complex with non-covalent benzothiazole-piperazine inhibitor ARN19702, in presence of Triton X-100