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- ChemComp-RYP: ~{N}-methyl-1-pyridin-4-yl-methanamine -

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Basic information

EntryDatabase: PDB chemical components / ID: RYP
NameName: ~{N}-methyl-1-pyridin-4-yl-methanamine

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Chemical information

Composition
Formula: C7H10N2 / Number of atoms: 19 / Formula weight: 122.168 / Formal charge: 0
Others

5r55

Type: NON-POLYMER / PDB classification: HETAIN / Three letter code: RYP / Ideal coordinates details: Corina / Model coordinates PDB-ID: 5R55
History
Create componentMar 2, 2020
Initial releaseApr 22, 2020
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 3.385CNCc1ccncc1
OpenEye OEToolkits 2.0.6CNCc1ccncc1

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SMILES CANONICAL

CACTVS 3.385CNCc1ccncc1
OpenEye OEToolkits 2.0.6CNCc1ccncc1

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InChI

InChI 1.03InChI=1S/C7H10N2/c1-8-6-7-2-4-9-5-3-7/h2-5,8H,6H2,1H3

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InChIKey

InChI 1.03DNBWGFKLIBQQSL-UHFFFAOYSA-N

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PDB entries

Showing all 4 items

PDB-5r55:
PanDDA analysis group deposition -- Crystal Structure of human NUDT22 in complex with N13369a

PDB-5ran:
PanDDA analysis group deposition -- Crystal Structure of JMJD1B in complex with XS039080d

PDB-5rze:
EPB41L3 PanDDA analysis group deposition -- Crystal Structure of the FERM domain of human EPB41L3 in complex with Z2856434786

PDB-7hh0:
PanDDA analysis group deposition -- Crystal structure of HRP-2 PWWP domain in complex with Z57390007

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