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Yorodumi- ChemComp-6XB: 1-(3-phenylazanyl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-5-yl)e... -
+Open data
-Basic information
Entry | Database: PDB chemical components / ID: 6XB |
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Name | Name: |
-Chemical information
Composition | Formula: C14H16N4O / Number of atoms: 35 / Formula weight: 256.303 / Formal charge: 0 | ||||
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Others | Type: NON-POLYMER / PDB classification: HETAIN / Three letter code: 6XB / Ideal coordinates details: Corina / Model coordinates PDB-ID: 5KTU | ||||
History |
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External links | BindingDB / UniChem / ChEMBL / Nikkaji / PubChem / SureChEMBL / ChemSpider / Wikipedia search / Google search |
-Structure visualization
Structure viewer | Molecule: MolmilJmol/JSmol |
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-Details
-SMILES
CACTVS 3.385 | OpenEye OEToolkits 2.0.5 | |
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-SMILES CANONICAL
CACTVS 3.385 | OpenEye OEToolkits 2.0.5 | |
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-InChI
InChI 1.03 |
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-InChIKey
InChI 1.03 |
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-SYSTEMATIC NAME
OpenEye OEToolkits 2.0.5 |
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-PDB entries
Showing all 1 items
PDB-5ktu:
Crystal structure of the bromodomain of human CREBBP bound to pyrazolopiperidine scaffold