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Yorodumi- ChemComp-MH4: 1-METHYL-8-{[4-(4-METHYLPIPERAZIN-1-YL)PHENYL]AMINO}-N-[(2-METHYL... -
+Open data
-Basic information
Entry | Database: PDB chemical components / ID: MH4 |
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Name | Name: |
-Chemical information
Composition | Formula: C29H33N9O / Number of atoms: 72 / Formula weight: 523.632 / Formal charge: 0 | ||||||
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Others | Type: non-polymer / PDB classification: HETAIN / Three letter code: MH4 / Ideal coordinates details: Corina / Model coordinates PDB-ID: 2XCK | ||||||
History |
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External links | UniChem / BindingDB / ChEMBL / PubChem / ZINC / ChemSpider / Wikipedia search / Google search |
-Structure visualization
Structure viewer | Molecule: MolmilJmol/JSmol |
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-Details
-SMILES
ACDLabs 10.04 | CACTVS 3.352 | OpenEye OEToolkits 1.6.1 | |
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-SMILES CANONICAL
CACTVS 3.352 | OpenEye OEToolkits 1.6.1 | |
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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 1.6.1 | |
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-PDB entries
Showing all 1 items
PDB-2xck:
Crystal structure of PDK1 in complex with a pyrazoloquinazoline inhibitor