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Yorodumi- ChemComp-EAM: 2-[(4S)-6-(4-chlorophenyl)-8-methoxy-1-methyl-4H-[1,2,4]triazolo[... -
+Open data
-Basic information
Entry | Database: PDB chemical components / ID: EAM |
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Name | Name: |
-Chemical information
Composition | Formula: C22H22ClN5O2 / Number of atoms: 52 / Formula weight: 423.895 / Formal charge: 0 | ||||||
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Others | Type: NON-POLYMER / PDB classification: HETAIN / Three letter code: EAM / Ideal coordinates details: Corina / Model coordinates PDB-ID: 3P5O | ||||||
History |
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External links | BindingDB / UniChem / ChEBI / ChEMBL / ChemicalBook / CompTox / DrugBank / GtoPharmacology / Nikkaji / PubChem / PubChem_TPharma / SureChEMBL / ZINC / ChemSpider / Wikipedia search / Google search |
-Structure visualization
Structure viewer | Molecule: MolmilJmol/JSmol |
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-Details
-SMILES
ACDLabs 12.01 | CACTVS 3.370 | OpenEye OEToolkits 1.7.0 | |
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-SMILES CANONICAL
CACTVS 3.370 | OpenEye OEToolkits 1.7.0 | |
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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 1.7.0 | |
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-PDB entries
Showing all 4 items
PDB-2yek:
Crystal Structure of the First Bromodomain of Human Brd2 with the inhibitor GSK525762 (IBET)
PDB-3p5o:
Crystal Structure of the First Bromodomain of Human Brd4 in complex with IBET inhibitor
PDB-5dfc:
Crystal structure of BRD2(BD2) W370F mutant with ligand I-BET 762 bound
PDB-7aqt:
NMR2 structure of BRD4-BD2 in complex with iBET-762