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Yorodumi- ChemComp-P8T: ~{N}-(2-aminophenyl)-4-[2-[(9~{S})-7-(4-chlorophenyl)-4,5,13-trim... -
+Open data
-Basic information
Entry | Database: PDB chemical components / ID: P8T |
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Name | Name: ~{ Synonyms: TW9 |
-Chemical information
Composition | Formula: C32H28ClN7O2S / Number of atoms: 71 / Formula weight: 610.128 / Formal charge: 0 | ||||||
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Others | Type: non-polymer / PDB classification: HETAIN / Three letter code: P8T / Ideal coordinates details: Corina / Model coordinates PDB-ID: 6YQN | ||||||
History |
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External links | UniChem / ChemSpider / ChEMBL / PubChem / 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-6yqn:
Crystal structure of the first bromodomain of human BRD4 in complex with the dual inhibitor TW9