+Open data
-Basic information
Entry | Database: PDB chemical components / ID: JGA |
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Name | Name: |
-Chemical information
Composition | Formula: C7H11N3O2 / Number of atoms: 23 / Formula weight: 169.181 / Formal charge: 0 | ||||
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Others | Type: NON-POLYMER / PDB classification: HETAIN / Three letter code: JGA / Ideal coordinates details: Corina / Model coordinates PDB-ID: 5QDP | ||||
History |
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External links | UniChem / ChemSpider / CompTox / PubChem / SureChEMBL / ZINC / Wikipedia search / Google search |
-Structure visualization
Structure viewer | Molecule: MolmilJmol/JSmol |
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-Details
-SMILES
ACDLabs 12.01 | CACTVS 3.385 | OpenEye OEToolkits 2.0.6 | |
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-SMILES CANONICAL
CACTVS 3.385 | OpenEye OEToolkits 2.0.6 | |
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-InChI
InChI 1.03 |
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-InChIKey
InChI 1.03 |
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-SYSTEMATIC NAME
ACDLabs 12.01 | OpenEye OEToolkits 2.0.6 | |
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-PDB entries
Showing all 5 items
PDB-5qdp:
PanDDA analysis group deposition -- Crystal structure of PTP1B in complex with compound_FMOPL000207a
PDB-5qqd:
PanDDA analysis group deposition -- Crystal Structure of Kalirin/Rac1 in complex with Z56880342
PDB-5sle:
PanDDA analysis group deposition -- Crystal Structure of SARS-CoV-2 NSP14 in complex with Z56880342
PDB-7b7w:
Notum-Fragment049
PDB-9f4s:
UP1 in complex with Z56880342