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Yorodumi- ChemComp-2BV: (R)-(cyclohexylmethyl)[(2S)-3-{[(1S)-1-(3,4-dichlorophenyl)ethyl]... -
+Open data
-Basic information
Entry | Database: PDB chemical components / ID: 2BV |
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Name | Name: ( Synonyms: CGP 54626 |
-Chemical information
Composition | Formula: C18H28Cl2NO3P / Number of atoms: 53 / Formula weight: 408.3 / Formal charge: 0 | ||||||
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Others | Type: NON-POLYMER / PDB classification: HETAIN / Three letter code: 2BV / Ideal coordinates details: Corina / Model coordinates PDB-ID: 4MR7 | ||||||
History |
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External links | UniChem / ChEMBL / 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 3.385 | 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 3 items
PDB-4mr7:
Crystal structure of the extracellular domain of human GABA(B) receptor bound to the antagonist CGP54626
PDB-7c7s:
Cryo-EM structure of the CGP54626-bound human GABA(B) receptor in inactive state.
PDB-7cum:
Cryo-EM structure of human GABA(B) receptor bound to the antagonist CGP54626