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Yorodumi- ChemComp-M04: 1-[4-(4-chlorobenzyl)-1-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)piperidi... -
+Open data
-Basic information
Entry | Database: PDB chemical components / ID: M04 |
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Name | Name: |
-Chemical information
Composition | Formula: C19H22ClN5 / Number of atoms: 47 / Formula weight: 355.864 / Formal charge: 0 | ||||||
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Others | Type: non-polymer / Three letter code: M04 / Ideal coordinates details: Corina / Model coordinates PDB-ID: 2VO3 | ||||||
History |
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External links | UniChem / ChemSpider / BindingDB / ChEMBL / DrugBank / PubChem / PubChem_TPharma / SureChEMBL / ZINC / 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-2vo3:
Structure of PKA-PKB chimera complexed with C-(4-(4-Chlorophenyl)-1-(7H-pyrrolo(2,3-d)pyrimidin-4-yl)piperidin-4-yl)methylamine