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Yorodumi- ChemComp-POO: 3-CYCLOHEXYL-1-(2-{METHYL[(1-METHYLPIPERIDIN-3-YL)METHYL]AMINO}-2... -
+Open data
-Basic information
Entry | Database: PDB chemical components / ID: POO |
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Name | Name: |
-Chemical information
Composition | Formula: C31H39N3O3 / Number of atoms: 76 / Formula weight: 501.66 / Formal charge: 0 | ||||||
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Others | Type: NON-POLYMER / PDB classification: HETAIN / Three letter code: POO / Model coordinates PDB-ID: 2BRL | ||||||
History |
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External links | UniChem / 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-2brl:
Crystal structure of Hepatitis C virus polymerase in complex with an allosteric inhibitor (compound 2)