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Yorodumi- ChemComp-J5Y: Nalpha-{4-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]-2-fluoroben... -
+Open data
-Basic information
Entry | Database: PDB chemical components / ID: J5Y |
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Name | Name: |
-Chemical information
Composition | Formula: C34H32ClFN6O2 / Number of atoms: 76 / Formula weight: 611.108 / Formal charge: 0 | ||||
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Others | Type: NON-POLYMER / PDB classification: HETAIN / Three letter code: J5Y / Ideal coordinates details: Corina / Model coordinates PDB-ID: 4UVR | ||||
History |
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External links | UniChem / ChemSpider / ChEMBL / Nikkaji / PubChem / SureChEMBL / ZINC / Wikipedia search / Google search |
-Structure visualization
Structure viewer | Molecule: MolmilJmol/JSmol |
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-Details
-SMILES
ACDLabs 12.01 | CACTVS 3.385 | OpenEye OEToolkits 1.7.6 | |
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-SMILES CANONICAL
CACTVS 3.385 | OpenEye OEToolkits 1.7.6 | |
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-InChI
InChI 1.03 |
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-InChIKey
InChI 1.03 |
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-SYSTEMATIC NAME
ACDLabs 12.01 | OpenEye OEToolkits 1.7.6 | |
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-PDB entries
Showing all 1 items
PDB-4uvr:
Binding mode, selectivity and potency of N-indolyl-oxopyridinyl-4- amino-propanyl-based inhibitors targeting Trypanosoma cruzi CYP51