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Yorodumi- ChemComp-JK1: 3-{4-[(phenylcarbamoyl)amino]-1H-pyrazol-1-yl}-N-(3,4,5-trimethox... -
+Open data
-Basic information
Entry | Database: PDB chemical components / ID: JK1 |
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Name | Name: Synonyms: 3-(4-(3-phenylureido)-1H-pyrazol-1-yl)-N-(3,4,5-trimethoxyphenyl)benzamide |
-Chemical information
Composition | Formula: C26H25N5O5 / Number of atoms: 61 / Formula weight: 487.507 / Formal charge: 0 | ||||||||
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Others | Type: NON-POLYMER / PDB classification: HETAIN / Three letter code: JK1 / Ideal coordinates details: Corina / Model coordinates PDB-ID: 3FI2 | ||||||||
History |
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External links | UniChem / ChemSpider / BindingDB / Brenda / ChEMBL / Nikkaji / PubChem / 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-3fi2:
Crystal structure of JNK3 with amino-pyrazole inhibitor, SR-3451