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Yorodumi- ChemComp-A3H: 4-(3-methylphenyl)-6-[(1-methylpyrazol-3-yl)amino]-1~{H}-pyrrolo[... -
+Open data
-Basic information
Entry | Database: PDB chemical components / ID: A3H |
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Name | Name: |
-Chemical information
Composition | Formula: C19H16N6 / Number of atoms: 41 / Formula weight: 328.371 / Formal charge: 0 | ||||
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Others | Type: NON-POLYMER / PDB classification: HETAIN / Three letter code: A3H / Ideal coordinates details: Corina / Model coordinates PDB-ID: 5OPV | ||||
History |
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External links | UniChem / BindingDB / ChEMBL / PubChem / SureChEMBL / ChemSpider / Wikipedia search / Google search |
-Structure visualization
Structure viewer | Molecule: MolmilJmol/JSmol |
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-Details
-SMILES
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
OpenEye OEToolkits 2.0.6 |
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-PDB entries
Showing all 1 items
PDB-5opv:
Structure of CHK1 10-pt. mutant complex with pyrrolopyridine LRRK2 inhibitor