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Yorodumi- ChemComp-CK7: [4-(2-AMINO-4-METHYL-THIAZOL-5-YL)-PYRIMIDIN-2-YL]-(3-NITRO-PHENY... -
+Open data
-Basic information
Entry | Database: PDB chemical components / ID: CK7 |
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Name | Name: [ |
-Chemical information
Composition | Formula: C14H12N6O2S / Number of atoms: 35 / Formula weight: 328.349 / Formal charge: 0 | ||||||
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Others | Type: NON-POLYMER / PDB classification: HETAIN / Three letter code: CK7 / Model coordinates PDB-ID: 1PXO | ||||||
History |
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External links | UniChem / ChemSpider / BindingDB / Brenda / ChEMBL / CompTox / DrugBank / PubChem / PubChem_TPharma / SureChEMBL / 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 3 items
PDB-1pxo:
HUMAN CYCLIN DEPENDENT KINASE 2 COMPLEXED WITH THE INHIBITOR [4-(2-Amino-4-methyl-thiazol-5-yl)-pyrimidin-2-yl]-(3-nitro-phenyl)-amine
PDB-2wev:
Truncation and Optimisation of Peptide Inhibitors of CDK2, Cyclin A Through Structure Guided Design
PDB-4b9d:
Crystal Structure of Human NIMA-related Kinase 1 (NEK1) with inhibitor.