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Yorodumi- ChemComp-3BA: 7-amino-2-tert-butyl-4-{[2-(1H-imidazol-4-yl)ethyl]amino}pyrido[2... -
+Open data
-Basic information
Entry | Database: PDB chemical components / ID: 3BA |
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Name | Name: |
-Chemical information
Composition | Formula: C17H22N8O / Number of atoms: 48 / Formula weight: 354.41 / Formal charge: 0 | ||||||
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Others | Type: NON-POLYMER / PDB classification: HETAIN / Three letter code: 3BA / Ideal coordinates details: Corina / Model coordinates PDB-ID: 3BAA | ||||||
History |
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External links | UniChem / DrugBank / PubChem / ZINC / ChemSpider / Wikipedia search / Google search |
-Structure visualization
Structure viewer | Molecule: MolmilJmol/JSmol |
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-Details
-SMILES
ACDLabs 10.04 | CACTVS 3.341 | OpenEye OEToolkits 1.5.0 | |
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-SMILES CANONICAL
CACTVS 3.341 | OpenEye OEToolkits 1.5.0 | |
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-InChI
InChI 1.03 |
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-InChIKey
InChI 1.03 |
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-SYSTEMATIC NAME
ACDLabs 10.04 | OpenEye OEToolkits 1.5.0 | |
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-PDB entries
Showing all 1 items
PDB-3baa:
Structural Basis for the Inhibition of Bacterial NAD+ Dependent DNA Ligase