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Yorodumi- ChemComp-B2X: 4-(5-chloro-1H,3H-benzo[de]isochromen-6-yl)-6-(methylsulfanyl)-1,... -
+Open data
-Basic information
Entry | Database: PDB chemical components / ID: B2X |
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Name | Name: |
-Chemical information
Composition | Formula: C16H13ClN4OS / Number of atoms: 36 / Formula weight: 344.819 / Formal charge: 0 | ||
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Others | Type: NON-POLYMER / PDB classification: HETAIN / Three letter code: B2X / Ideal coordinates details: Corina / Model coordinates PDB-ID: 3B28 | ||
History |
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External links | UniChem / ChemSpider / BindingDB / ChEMBL / Nikkaji / PubChem / PubChem_TPharma / SureChEMBL / ZINC / Wikipedia search / Google search |
-Structure visualization
Structure viewer | Molecule: MolmilJmol/JSmol |
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-Details
-SMILES
ACDLabs 12.01 | CACTVS 3.370 | OpenEye OEToolkits 1.7.2 | |
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-SMILES CANONICAL
CACTVS 3.370 | OpenEye OEToolkits 1.7.2 | |
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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 |
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-PDB entries
Showing all 1 items
PDB-3b28:
Hsp90 alpha N-terminal domain in complex with an inhibitor CH5015765