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Yorodumi- ChemComp-D42: 1-(3-(2,4-DIMETHYLTHIAZOL-5-YL)-4-OXO-2,4-DIHYDROINDENO[1,2-C]PYR... -
+Open data
-Basic information
Entry | Database: PDB chemical components / ID: D42 |
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Name | Name: Synonyms: DPH-042562 |
-Chemical information
Composition | Formula: C21H23N7O2S / Number of atoms: 54 / Formula weight: 437.518 / Formal charge: 0 | ||||||||
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Others | Type: NON-POLYMER / PDB classification: HETAIN / Three letter code: D42 / Model coordinates PDB-ID: 2B52 | ||||||||
History |
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External links | BindingDB / UniChem / ChEMBL / DrugBank / Nikkaji / PubChem / PubChem_TPharma / SureChEMBL / 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-2b52:
Human cyclin dependent kinase 2 (CDK2) complexed with DPH-042562