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Yorodumi- ChemComp-I34: N-(5-Chloro-2,4-dimethoxyphenyl)-N'-(5-methyl-3-isoxazolyl)-urea -
+Open data
-Basic information
Entry | Database: PDB chemical components / ID: I34 |
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Name | Name: |
-Chemical information
Composition | Formula: C13H14ClN3O4 / Number of atoms: 35 / Formula weight: 311.721 / Formal charge: 0 | ||||
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Others | Type: non-polymer / PDB classification: HETAIN / Three letter code: I34 / Ideal coordinates details: Corina / Model coordinates PDB-ID: 7EKT | ||||
History |
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External links | UniChem / ChemSpider / BindingDB / ChEBI / ChEMBL / ChemicalBook / GtoPharmacology / Nikkaji / PubChem / PubChem_TPharma / SureChEMBL / ZINC / Wikipedia search / Google search |
-Structure visualization
Structure viewer | Molecule: MolmilJmol/JSmol |
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-Details
-SMILES
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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-PDB entries
Showing all 5 items
PDB-7ekt:
human alpha 7 nicotinic acetylcholine receptor bound to EVP-6124 and PNU-120596
PDB-8v82:
Alpha7-nicotinic acetylcholine receptor bound to epibatidine and PNU-120596
PDB-8v8a:
Alpha7-nicotinic acetylcholine receptor time resolved bound to epibatidine and PNU-120596 desensitized intermediate state
PDB-8v8c:
Alpha7-nicotinic acetylcholine receptor time resolved bound to epibatidine and PNU-120596 asymmetric state 1
PDB-8v8d:
Alpha7-nicotinic acetylcholine receptor time resolved bound to epibatidine and PNU-120596 asymmetric state 2