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Yorodumi- ChemComp-OOM: N-(3-tert-butyl-1-phenyl-1H-pyrazol-5-yl)-2-{[1-(4-hydroxyphenyl)... -
+Open data
-Basic information
Entry | Database: PDB chemical components / ID: OOM |
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Name | Name: |
-Chemical information
Composition | Formula: C22H23N7O2S / Number of atoms: 55 / Formula weight: 449.529 / Formal charge: 0 | ||||
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Others | Type: NON-POLYMER / PDB classification: HETAIN / Three letter code: OOM / Ideal coordinates details: Corina / Model coordinates PDB-ID: 6PL2 | ||||
History |
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External links | UniChem / ChemSpider / PubChem / 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 2.0.7 | |
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-SMILES CANONICAL
CACTVS 3.385 | OpenEye OEToolkits 2.0.7 | |
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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 2.0.7 | ~{ | |
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-PDB entries
Showing all 1 items
PDB-6pl2:
TRK-A IN COMPLEX WITH LIGAND 1a