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- ChemComp-5SH: 4-phenylpyridine -

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Basic information

EntryDatabase: PDB chemical components / ID: 5SH
NameName: 4-phenylpyridine

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Chemical information

Composition
Formula: C11H9N / Number of atoms: 21 / Formula weight: 155.196 / Formal charge: 0
Others

5ewd

Type: NON-POLYMER / PDB classification: HETAIN / Three letter code: 5SH / Ideal coordinates details: Corina / Model coordinates PDB-ID: 5EWD
History
Create componentNov 21, 2015
Initial releaseMay 25, 2016
External linksUniChem / ChemSpider / Wikipedia search / Google search

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Structure visualization

Structure viewerMolecule:
MolmilJmol/JSmol

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Details

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SMILES

CACTVS 3.385c1ccc(cc1)c2ccncc2
OpenEye OEToolkits 2.0.4c1ccc(cc1)c2ccncc2

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SMILES CANONICAL

CACTVS 3.385c1ccc(cc1)c2ccncc2
OpenEye OEToolkits 2.0.4c1ccc(cc1)c2ccncc2

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InChI

InChI 1.03InChI=1S/C11H9N/c1-2-4-10(5-3-1)11-6-8-12-9-7-11/h1-9H

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InChIKey

InChI 1.03JVZRCNQLWOELDU-UHFFFAOYSA-N

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SYSTEMATIC NAME

OpenEye OEToolkits 2.0.44-phenylpyridine

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PDB entries

Showing all 2 items

PDB-5ewd:
Crystal structure of the human BRPF1 bromodomain in complex with SEED18

PDB-7h4t:
Group deposition for crystallographic fragment screening of Coxsackievirus A16 (G-10) 2A protease -- Crystal structure of Coxsackievirus A16 (G-10) 2A protease in complex with Z276142580 (A71EV2A-x1105)

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